N-(3-cyano-6-cyclopropyl-4-phenyl-2-pyridinyl)acetamide

C17H15N3O — CID 668132

IUPACN-(3-cyano-6-cyclopropyl-4-phenyl-2-pyridinyl)acetamide
SMILESCC(=O)Nc1nc(C2CC2)cc(-c2ccccc2)c1C#N
InChIInChI=1S/C17H15N3O/c1-11(21)19-17-15(10-18)14(12-5-3-2-4-6-12)9-16(20-17)13-7-8-13/h2-6,9,13H,7-8H2,1H3,(H,19,20,21)
InChIKeyZVCLOLPSCDOOPA-UHFFFAOYSA-N
MW277.33 g/mol
LogP3.46
Rot. Bonds3

About N-(3-cyano-6-cyclopropyl-4-phenyl-2-pyridinyl)acetamide

N-(3-cyano-6-cyclopropyl-4-phenyl-2-pyridinyl)acetamide (PubChem CID 668132) has the molecular formula C17H15N3O and a molecular weight of 277.33 g/mol. Its IUPAC name is N-(3-cyano-6-cyclopropyl-4-phenyl-2-pyridinyl)acetamide.

Molecular Properties

Compound NameN-(3-cyano-6-cyclopropyl-4-phenyl-2-pyridinyl)acetamide
PubChem CID668132
Molecular FormulaC17H15N3O
Molecular Weight277.33 g/mol
Exact Mass277.12
IUPAC NameN-(3-cyano-6-cyclopropyl-4-phenyl-2-pyridinyl)acetamide
SMILESCC(=O)Nc1nc(C2CC2)cc(-c2ccccc2)c1C#N
InChIInChI=1S/C17H15N3O/c1-11(21)19-17-15(10-18)14(12-5-3-2-4-6-12)9-16(20-17)13-7-8-13/h2-6,9,13H,7-8H2,1H3,(H,19,20,21)
InChIKeyZVCLOLPSCDOOPA-UHFFFAOYSA-N
XLogP3.46
TPSA65.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.33
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ST001233
CID 610514
N-(2,6-diphenylpyrimidin-4-yl)acetamide
CID 11185362
N-(4-amino-5-cyano-6-phenylpyridin-2-yl)acetamide
CID 11658882
N-(4,6-dimethylpyridin-2-yl)-2-phenylbutanamide
CID 2852109
3-Cyano-4-phenyl-N-(6-methylpyridin-2-yl)-benzamide
CID 24965063
3-cyano-N-(6-methylpyridin-2-yl)benzamide
CID 16007001
3-cyano-N-(6-ethylpyridin-2-yl)-5-fluorobenzamide
CID 49862385
N-[6-(2,3-dimethylphenyl)-4-(methylamino)-2-pyridinyl]acetamide
CID 155527650
2-(4-Fluoro-phenylamino)-4,6-dimethyl-nicotinonitrile
CID 706821
N-(3-Cyano-4,6-dimethyl-pyridin-2-yl)-N-p-tolyl-acetamide
CID 781001
2-(2,3-Dimethyl-phenylamino)-4,6-dimethyl-nicotinonitrile
CID 856352
N-(4-methylphenyl)-N'-(6-methylpyridin-2-yl)urea
CID 3966223

Frequently Asked Questions

What is the IUPAC name of N-(3-cyano-6-cyclopropyl-4-phenyl-2-pyridinyl)acetamide?
The IUPAC name of N-(3-cyano-6-cyclopropyl-4-phenyl-2-pyridinyl)acetamide (CID 668132) is N-(3-cyano-6-cyclopropyl-4-phenyl-2-pyridinyl)acetamide.
What is the SMILES notation for N-(3-cyano-6-cyclopropyl-4-phenyl-2-pyridinyl)acetamide?
The canonical SMILES for N-(3-cyano-6-cyclopropyl-4-phenyl-2-pyridinyl)acetamide is CC(=O)Nc1nc(C2CC2)cc(-c2ccccc2)c1C#N.
What is the InChIKey of N-(3-cyano-6-cyclopropyl-4-phenyl-2-pyridinyl)acetamide?
The InChIKey is ZVCLOLPSCDOOPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O/c1-11(21)19-17-15(10-18)14(12-5-3-2-4-6-12)9-16(20-17)13-7-8-13/h2-6,9,13H,7-8H2,1H3,(H,19,20,21).
What are the key properties of N-(3-cyano-6-cyclopropyl-4-phenyl-2-pyridinyl)acetamide?
N-(3-cyano-6-cyclopropyl-4-phenyl-2-pyridinyl)acetamide has a molecular weight of 277.33 g/mol, XLogP of 3.46, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyano-6-cyclopropyl-4-phenyl-2-pyridinyl)acetamide is sourced from PubChem (CID 668132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).