Home Other Building Blocks N-Methyl-1H-pyrrole-2-carboxamide

N-Methyl-1H-pyrrole-2-carboxamide

CAS No.:
132911-42-3
Catalog Number:
AG0011D8
Molecular Formula:
C6H8N2O
Molecular Weight:
124.1405
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$75
- +
5g
97%
In Stock USA
United States
$225
- +
25g
97%
In Stock USA
United States
$850
- +
Product Description
Catalog Number:
AG0011D8
Chemical Name:
N-Methyl-1H-pyrrole-2-carboxamide
CAS Number:
132911-42-3
Molecular Formula:
C6H8N2O
Molecular Weight:
124.1405
MDL Number:
MFCD15143555
IUPAC Name:
N-methyl-1H-pyrrole-2-carboxamide
InChI:
InChI=1S/C6H8N2O/c1-7-6(9)5-3-2-4-8-5/h2-4,8H,1H3,(H,7,9)
InChI Key:
LBZQAEQLSRWNLM-UHFFFAOYSA-N
SMILES:
CNC(=O)c1ccc[nH]1
Properties
Complexity:
114  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
124.064g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
124.143g/mol
Monoisotopic Mass:
124.064g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
44.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Literature
Title Journal
Design, synthesis and biological evaluation of a novel series of anthrapyrazoles linked with netropsin-like oligopyrrole carboxamides as anticancer agents. Bioorganic & medicinal chemistry 20100601
Effects of the N-terminal acylamido group of imidazole- and pyrrole-containing polyamides on DNA sequence specificity and binding affinity. Biochemistry 20090623
DNA damage and cytotoxicity induced by minor groove binding methyl sulfonate esters. Biochemistry 20031209
Antitumor AHMA linked to DNA minor groove binding agents: synthesis and biological evaluation. Journal of medicinal chemistry 20020926
DNA binding properties of novel dansylated distamycin analogues in which the fluorophore is directly conjugated to the N-methyl-pyrrole. Journal of biomolecular structure & dynamics 20020401
Unusual DNA binding exhibited by synthetic distamycin analogues lacking the N-terminal amide unit under high salt conditions. Journal of biomolecular structure & dynamics 20010601
Properties