Home Other Building Blocks 1-methyl-N-[(thiophen-2-yl)methyl]-1H-pyrazole-5-carboxamide

1-methyl-N-[(thiophen-2-yl)methyl]-1H-pyrazole-5-carboxamide

CAS No.:
515847-82-2
Catalog Number:
AG01ELRJ
Molecular Formula:
C10H11N3OS
Molecular Weight:
221.2788
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Product Description
Catalog Number:
AG01ELRJ
Chemical Name:
1-methyl-N-[(thiophen-2-yl)methyl]-1H-pyrazole-5-carboxamide
CAS Number:
515847-82-2
Molecular Formula:
C10H11N3OS
Molecular Weight:
221.2788
MDL Number:
MFCD03759065
IUPAC Name:
2-methyl-N-(thiophen-2-ylmethyl)pyrazole-3-carboxamide
InChI:
InChI=1S/C10H11N3OS/c1-13-9(4-5-12-13)10(14)11-7-8-3-2-6-15-8/h2-6H,7H2,1H3,(H,11,14)
InChI Key:
KZOMSPKSWBGZMC-UHFFFAOYSA-N
SMILES:
O=C(c1ccnn1C)NCc1cccs1
Properties
Complexity:
237  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.062g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
221.278g/mol
Monoisotopic Mass:
221.062g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
75.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties