3-cyano-N-(5-phenyl-3-pyridinyl)benzamide

C19H13N3O — CID 110713713

IUPAC3-cyano-N-(5-phenyl-3-pyridinyl)benzamide
SMILESN#Cc1cccc(C(=O)Nc2cncc(-c3ccccc3)c2)c1
InChIInChI=1S/C19H13N3O/c20-11-14-5-4-8-16(9-14)19(23)22-18-10-17(12-21-13-18)15-6-2-1-3-7-15/h1-10,12-13H,(H,22,23)
InChIKeyAHHCNFGSRKUQKI-UHFFFAOYSA-N
MW299.33 g/mol
LogP3.87
Rot. Bonds3

About 3-cyano-N-(5-phenyl-3-pyridinyl)benzamide

3-cyano-N-(5-phenyl-3-pyridinyl)benzamide (PubChem CID 110713713) has the molecular formula C19H13N3O and a molecular weight of 299.33 g/mol. Its IUPAC name is 3-cyano-N-(5-phenyl-3-pyridinyl)benzamide.

Molecular Properties

Compound Name3-cyano-N-(5-phenyl-3-pyridinyl)benzamide
PubChem CID110713713
Molecular FormulaC19H13N3O
Molecular Weight299.33 g/mol
Exact Mass299.11
IUPAC Name3-cyano-N-(5-phenyl-3-pyridinyl)benzamide
SMILESN#Cc1cccc(C(=O)Nc2cncc(-c3ccccc3)c2)c1
InChIInChI=1S/C19H13N3O/c20-11-14-5-4-8-16(9-14)19(23)22-18-10-17(12-21-13-18)15-6-2-1-3-7-15/h1-10,12-13H,(H,22,23)
InChIKeyAHHCNFGSRKUQKI-UHFFFAOYSA-N
XLogP3.87
TPSA65.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.33
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-cyano-N-(5-methyl-3-pyridinyl)benzamide
CID 110727253
3-cyano-N-(5-methyl-3-pyridinyl)benzamide;ethane
CID 145349636
3-cyano-N-(5-pyrimidin-5-yloxy-3-pyridinyl)benzamide
CID 58349136
3-cyano-N-[3-(2-phenyl-1,3-thiazol-4-yl)phenyl]benzamide
CID 122286155
5-[(3-cyanobenzoyl)amino]benzene-1,3-dicarboxylic acid
CID 10448085
3-cyano-N-[(4-phenylphenyl)carbamothioyl]benzamide
CID 87470907
3,4-dimethoxy-N-(5-phenyl-3-pyridinyl)benzamide
CID 110713719
N,5-diphenylpyridine-3-carboxamide
CID 110683714
N-(4-chlorophenyl)-3-cyanobenzamide
CID 1475891
3-cyano-N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]benzamide
CID 7948158
N-(3-cyanophenyl)-4-[4-[(3-cyanophenyl)carbamoyl]phenyl]benzamide
CID 90213286
N-(3-acetylphenyl)-5-(3-cyanoanilino)pyridine-3-carboxamide
CID 109245786

Frequently Asked Questions

What is the IUPAC name of 3-cyano-N-(5-phenyl-3-pyridinyl)benzamide?
The IUPAC name of 3-cyano-N-(5-phenyl-3-pyridinyl)benzamide (CID 110713713) is 3-cyano-N-(5-phenyl-3-pyridinyl)benzamide.
What is the SMILES notation for 3-cyano-N-(5-phenyl-3-pyridinyl)benzamide?
The canonical SMILES for 3-cyano-N-(5-phenyl-3-pyridinyl)benzamide is N#Cc1cccc(C(=O)Nc2cncc(-c3ccccc3)c2)c1.
What is the InChIKey of 3-cyano-N-(5-phenyl-3-pyridinyl)benzamide?
The InChIKey is AHHCNFGSRKUQKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13N3O/c20-11-14-5-4-8-16(9-14)19(23)22-18-10-17(12-21-13-18)15-6-2-1-3-7-15/h1-10,12-13H,(H,22,23).
What are the key properties of 3-cyano-N-(5-phenyl-3-pyridinyl)benzamide?
3-cyano-N-(5-phenyl-3-pyridinyl)benzamide has a molecular weight of 299.33 g/mol, XLogP of 3.87, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyano-N-(5-phenyl-3-pyridinyl)benzamide is sourced from PubChem (CID 110713713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).