N-(1H-benzimidazol-2-yl)-3-cyanobenzamide

C15H10N4O — CID 2635761

IUPACN-(1H-benzimidazol-2-yl)-3-cyanobenzamide
SMILESN#Cc1cccc(C(=O)Nc2nc3ccccc3[nH]2)c1
InChIInChI=1S/C15H10N4O/c16-9-10-4-3-5-11(8-10)14(20)19-15-17-12-6-1-2-7-13(12)18-15/h1-8H,(H2,17,18,19,20)
InChIKeyJSWLIGOCNPPDTR-UHFFFAOYSA-N
MW262.27 g/mol
LogP2.69
Rot. Bonds2

About N-(1H-benzimidazol-2-yl)-3-cyanobenzamide

N-(1H-benzimidazol-2-yl)-3-cyanobenzamide (PubChem CID 2635761) has the molecular formula C15H10N4O and a molecular weight of 262.27 g/mol. Its IUPAC name is N-(1H-benzimidazol-2-yl)-3-cyanobenzamide.

Molecular Properties

Compound NameN-(1H-benzimidazol-2-yl)-3-cyanobenzamide
PubChem CID2635761
Molecular FormulaC15H10N4O
Molecular Weight262.27 g/mol
Exact Mass262.09
IUPAC NameN-(1H-benzimidazol-2-yl)-3-cyanobenzamide
SMILESN#Cc1cccc(C(=O)Nc2nc3ccccc3[nH]2)c1
InChIInChI=1S/C15H10N4O/c16-9-10-4-3-5-11(8-10)14(20)19-15-17-12-6-1-2-7-13(12)18-15/h1-8H,(H2,17,18,19,20)
InChIKeyJSWLIGOCNPPDTR-UHFFFAOYSA-N
XLogP2.69
TPSA81.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.27
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-(1H-benzimidazol-2-yl)benzamide
CID 62060005
N-(1H-benzimidazol-2-yl)-2-cyanopyridine-4-carboxamide
CID 112527987
N-(1H-benzimidazol-2-yl)-3-(dimethylsulfamoyl)benzamide
CID 2583610
N-(1H-benzimidazol-2-yl)-3-cyano-4-pyrrolidin-1-ylbenzamide
CID 122136797
N-(1H-benzimidazol-2-yl)-1H-benzimidazole-2-carboxamide
CID 12620222
N-(1H-benzimidazol-2-yl)-3-(2,2-dimethylpropanoylamino)benzamide
CID 30476399
N-(1H-benzimidazol-2-yl)pyridine-4-carboxamide
CID 896334
N-[3-(1H-benzimidazol-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3-cyanobenzamide
CID 18229502
2-amino-N-(1H-benzimidazol-2-yl)pyridine-4-carboxamide
CID 63565075
N-(1H-benzimidazol-2-yl)-3-(phenylsulfamoyl)benzamide
CID 155294875
4-(1H-benzimidazol-2-ylcarbamoyl)pyridine-2-carboxylic acid
CID 115730029
N-(1H-benzimidazol-2-yl)-3-(3,6-dioxo-1H-pyridazin-2-yl)benzamide
CID 49017160

Frequently Asked Questions

What is the IUPAC name of N-(1H-benzimidazol-2-yl)-3-cyanobenzamide?
The IUPAC name of N-(1H-benzimidazol-2-yl)-3-cyanobenzamide (CID 2635761) is N-(1H-benzimidazol-2-yl)-3-cyanobenzamide.
What is the SMILES notation for N-(1H-benzimidazol-2-yl)-3-cyanobenzamide?
The canonical SMILES for N-(1H-benzimidazol-2-yl)-3-cyanobenzamide is N#Cc1cccc(C(=O)Nc2nc3ccccc3[nH]2)c1.
What is the InChIKey of N-(1H-benzimidazol-2-yl)-3-cyanobenzamide?
The InChIKey is JSWLIGOCNPPDTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N4O/c16-9-10-4-3-5-11(8-10)14(20)19-15-17-12-6-1-2-7-13(12)18-15/h1-8H,(H2,17,18,19,20).
What are the key properties of N-(1H-benzimidazol-2-yl)-3-cyanobenzamide?
N-(1H-benzimidazol-2-yl)-3-cyanobenzamide has a molecular weight of 262.27 g/mol, XLogP of 2.69, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-benzimidazol-2-yl)-3-cyanobenzamide is sourced from PubChem (CID 2635761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).