N-(2-cyanophenyl)-2-(2-methylbenzimidazol-1-yl)acetamide

C17H14N4O — CID 40689130

IUPACN-(2-cyanophenyl)-2-(2-methylbenzimidazol-1-yl)acetamide
SMILESCc1nc2ccccc2n1CC(=O)Nc1ccccc1C#N
InChIInChI=1S/C17H14N4O/c1-12-19-15-8-4-5-9-16(15)21(12)11-17(22)20-14-7-3-2-6-13(14)10-18/h2-9H,11H2,1H3,(H,20,22)
InChIKeyRZQFSLWDNWGJAC-UHFFFAOYSA-N
MW290.33 g/mol
LogP2.86
Rot. Bonds3

About N-(2-cyanophenyl)-2-(2-methylbenzimidazol-1-yl)acetamide

N-(2-cyanophenyl)-2-(2-methylbenzimidazol-1-yl)acetamide (PubChem CID 40689130) has the molecular formula C17H14N4O and a molecular weight of 290.33 g/mol. Its IUPAC name is N-(2-cyanophenyl)-2-(2-methylbenzimidazol-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-cyanophenyl)-2-(2-methylbenzimidazol-1-yl)acetamide
PubChem CID40689130
Molecular FormulaC17H14N4O
Molecular Weight290.33 g/mol
Exact Mass290.12
IUPAC NameN-(2-cyanophenyl)-2-(2-methylbenzimidazol-1-yl)acetamide
SMILESCc1nc2ccccc2n1CC(=O)Nc1ccccc1C#N
InChIInChI=1S/C17H14N4O/c1-12-19-15-8-4-5-9-16(15)21(12)11-17(22)20-14-7-3-2-6-13(14)10-18/h2-9H,11H2,1H3,(H,20,22)
InChIKeyRZQFSLWDNWGJAC-UHFFFAOYSA-N
XLogP2.86
TPSA70.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.33
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-tert-butylbenzimidazol-1-yl)-N-(2-cyanophenyl)acetamide
CID 23008463
N-(2-cyanophenyl)-2-[2-(2-methylpropyl)benzimidazol-1-yl]acetamide
CID 39148117
2-(2-butylbenzimidazol-1-yl)-N-(2-cyanophenyl)acetamide
CID 39148056
N-(2-cyanophenyl)-2-(6-methyl-[1,3]dioxolo[4,5-f]benzimidazol-7-yl)acetamide
CID 39158171
methyl 2-[[2-(2-methylbenzimidazol-1-yl)acetyl]amino]benzoate
CID 18166122
2-(2-methylbenzimidazol-1-yl)-N-(4-nitrophenyl)acetamide
CID 7755868
N-(4-iodophenyl)-2-(2-methylbenzimidazol-1-yl)acetamide
CID 7755726
N-(2-cyanophenyl)-2-(2,5,6-trimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide
CID 39159273
N-[(Z)-(4-cyanophenyl)methylideneamino]-2-(2-methylbenzimidazol-1-yl)acetamide
CID 9121431
N-(5-chloro-2-pyridinyl)-2-(2-methylbenzimidazol-1-yl)acetamide
CID 40688756
ethyl 4-[[2-(2-methylbenzimidazol-1-yl)acetyl]amino]benzoate
CID 40540953
[2-(2-nitroanilino)-2-oxoethyl] 2-(2-methylbenzimidazol-1-yl)acetate
CID 3929351

Frequently Asked Questions

What is the IUPAC name of N-(2-cyanophenyl)-2-(2-methylbenzimidazol-1-yl)acetamide?
The IUPAC name of N-(2-cyanophenyl)-2-(2-methylbenzimidazol-1-yl)acetamide (CID 40689130) is N-(2-cyanophenyl)-2-(2-methylbenzimidazol-1-yl)acetamide.
What is the SMILES notation for N-(2-cyanophenyl)-2-(2-methylbenzimidazol-1-yl)acetamide?
The canonical SMILES for N-(2-cyanophenyl)-2-(2-methylbenzimidazol-1-yl)acetamide is Cc1nc2ccccc2n1CC(=O)Nc1ccccc1C#N.
What is the InChIKey of N-(2-cyanophenyl)-2-(2-methylbenzimidazol-1-yl)acetamide?
The InChIKey is RZQFSLWDNWGJAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N4O/c1-12-19-15-8-4-5-9-16(15)21(12)11-17(22)20-14-7-3-2-6-13(14)10-18/h2-9H,11H2,1H3,(H,20,22).
What are the key properties of N-(2-cyanophenyl)-2-(2-methylbenzimidazol-1-yl)acetamide?
N-(2-cyanophenyl)-2-(2-methylbenzimidazol-1-yl)acetamide has a molecular weight of 290.33 g/mol, XLogP of 2.86, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanophenyl)-2-(2-methylbenzimidazol-1-yl)acetamide is sourced from PubChem (CID 40689130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).