2-(2-cyanophenyl)-N-cyclopentyl-N-methylbenzamide

C20H20N2O — CID 51268476

IUPAC2-(2-cyanophenyl)-N-cyclopentyl-N-methylbenzamide
SMILESCN(C(=O)c1ccccc1-c1ccccc1C#N)C1CCCC1
InChIInChI=1S/C20H20N2O/c1-22(16-9-3-4-10-16)20(23)19-13-7-6-12-18(19)17-11-5-2-8-15(17)14-21/h2,5-8,11-13,16H,3-4,9-10H2,1H3
InChIKeyWWPHKSAWGOLXLK-UHFFFAOYSA-N
MW304.39 g/mol
LogP4.24
Rot. Bonds3

About 2-(2-cyanophenyl)-N-cyclopentyl-N-methylbenzamide

2-(2-cyanophenyl)-N-cyclopentyl-N-methylbenzamide (PubChem CID 51268476) has the molecular formula C20H20N2O and a molecular weight of 304.39 g/mol. Its IUPAC name is 2-(2-cyanophenyl)-N-cyclopentyl-N-methylbenzamide.

Molecular Properties

Compound Name2-(2-cyanophenyl)-N-cyclopentyl-N-methylbenzamide
PubChem CID51268476
Molecular FormulaC20H20N2O
Molecular Weight304.39 g/mol
Exact Mass304.16
IUPAC Name2-(2-cyanophenyl)-N-cyclopentyl-N-methylbenzamide
SMILESCN(C(=O)c1ccccc1-c1ccccc1C#N)C1CCCC1
InChIInChI=1S/C20H20N2O/c1-22(16-9-3-4-10-16)20(23)19-13-7-6-12-18(19)17-11-5-2-8-15(17)14-21/h2,5-8,11-13,16H,3-4,9-10H2,1H3
InChIKeyWWPHKSAWGOLXLK-UHFFFAOYSA-N
XLogP4.24
TPSA44.10 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-cyanophenyl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylbenzamide
CID 78808882
2-(3-aminoprop-1-ynyl)-N-cycloheptyl-N-methylbenzamide
CID 60821770
7-cyano-N-cyclopentyl-N-methyl-1H-indole-2-carboxamide
CID 166476068
2-bromo-N-cycloheptyl-N-methylbenzamide
CID 43409214
2-[cyclohexyl(methyl)carbamoyl]benzoate
CID 2302400
2-amino-N-cyclobutyl-N-methylbenzamide
CID 115747527
N-cycloheptyl-N-methyl-2-(trifluoromethyl)benzamide
CID 55469731
N-cyclohexyl-2-[cyclopropyl(methyl)amino]-N-methylbenzamide
CID 174458205
2-(4-bromobenzoyl)-N-cyclohexyl-N-methylbenzamide
CID 112811303
2-chloro-N-cycloheptyl-N-methylpyridine-3-carboxamide
CID 43409219
3-amino-N-cyclohexyl-2-hydroxy-N-methylbenzamide
CID 58736495
2-(2-aminophenyl)sulfanyl-N-cyclopentyl-N-methylbenzamide
CID 166391273

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyanophenyl)-N-cyclopentyl-N-methylbenzamide?
The IUPAC name of 2-(2-cyanophenyl)-N-cyclopentyl-N-methylbenzamide (CID 51268476) is 2-(2-cyanophenyl)-N-cyclopentyl-N-methylbenzamide.
What is the SMILES notation for 2-(2-cyanophenyl)-N-cyclopentyl-N-methylbenzamide?
The canonical SMILES for 2-(2-cyanophenyl)-N-cyclopentyl-N-methylbenzamide is CN(C(=O)c1ccccc1-c1ccccc1C#N)C1CCCC1.
What is the InChIKey of 2-(2-cyanophenyl)-N-cyclopentyl-N-methylbenzamide?
The InChIKey is WWPHKSAWGOLXLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O/c1-22(16-9-3-4-10-16)20(23)19-13-7-6-12-18(19)17-11-5-2-8-15(17)14-21/h2,5-8,11-13,16H,3-4,9-10H2,1H3.
What are the key properties of 2-(2-cyanophenyl)-N-cyclopentyl-N-methylbenzamide?
2-(2-cyanophenyl)-N-cyclopentyl-N-methylbenzamide has a molecular weight of 304.39 g/mol, XLogP of 4.24, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyanophenyl)-N-cyclopentyl-N-methylbenzamide is sourced from PubChem (CID 51268476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).