Name: Name:N-[1-(2-cyanoethyl)-3-methyl-1H-pyrazol-5-yl]acetamide
Brand: Angene
SKU: AG019V9X
Rating: 90 (10 reviews)

N-[1-(2-cyanoethyl)-3-methyl-1H-pyrazol-5-yl]acetamide

CAS No.:

1181457-80-6

Catalog Number:

AG019V9X

Molecular Formula:

C9H12N4O

Molecular Weight:

192.2178

Catalog Number:

AG019V9X

Chemical Name:

N-[1-(2-cyanoethyl)-3-methyl-1H-pyrazol-5-yl]acetamide

CAS Number:

1181457-80-6

Molecular Formula:

C9H12N4O

Molecular Weight:

192.2178

MDL Number:

MFCD12197086

IUPAC Name:

N-[2-(2-cyanoethyl)-5-methylpyrazol-3-yl]acetamide

InChI:

InChI=1S/C9H12N4O/c1-7-6-9(11-8(2)14)13(12-7)5-3-4-10/h6H,3,5H2,1-2H3,(H,11,14)

InChI Key:

IETHPFHBAVOFJD-UHFFFAOYSA-N

SMILES:

Cc1cc(n(n1)CCC#N)NC(=O)C

Complexity:

257

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

192.101g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

192.222g/mol

Monoisotopic Mass:

192.101g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

70.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.2