Home Other Building Blocks N-Methyl-n-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]amine

N-Methyl-n-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]amine

CAS No.:
166187-00-4
Catalog Number:
AG00AB6K
Molecular Formula:
C8H17N3O
Molecular Weight:
171.2401
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
1 week
United States
$144
- +
5g
98%
1 week
United States
$457
- +
Product Description
Catalog Number:
AG00AB6K
Chemical Name:
N-Methyl-n-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]amine
CAS Number:
166187-00-4
Molecular Formula:
C8H17N3O
Molecular Weight:
171.2401
MDL Number:
MFCD06366274
IUPAC Name:
2-(methylamino)-1-(4-methylpiperazin-1-yl)ethanone
InChI:
InChI=1S/C8H17N3O/c1-9-7-8(12)11-5-3-10(2)4-6-11/h9H,3-7H2,1-2H3
InChI Key:
CKRGUQFETZTMME-UHFFFAOYSA-N
SMILES:
CNCC(=O)N1CCN(CC1)C
Properties
Complexity:
152  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.137g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
171.244g/mol
Monoisotopic Mass:
171.137g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
35.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties