N-[2-(cyclohexylcarbamoyl)phenyl]-2,4-dimethylbenzamide

C22H26N2O2 — CID 100720174

IUPACN-[2-(cyclohexylcarbamoyl)phenyl]-2,4-dimethylbenzamide
SMILESCc1ccc(C(=O)Nc2ccccc2C(=O)NC2CCCCC2)c(C)c1
InChIInChI=1S/C22H26N2O2/c1-15-12-13-18(16(2)14-15)21(25)24-20-11-7-6-10-19(20)22(26)23-17-8-4-3-5-9-17/h6-7,10-14,17H,3-5,8-9H2,1-2H3,(H,23,26)(H,24,25)
InChIKeyVUSPRFKMMACCRW-UHFFFAOYSA-N
MW350.46 g/mol
LogP4.62
Rot. Bonds4

About N-[2-(cyclohexylcarbamoyl)phenyl]-2,4-dimethylbenzamide

N-[2-(cyclohexylcarbamoyl)phenyl]-2,4-dimethylbenzamide (PubChem CID 100720174) has the molecular formula C22H26N2O2 and a molecular weight of 350.46 g/mol. Its IUPAC name is N-[2-(cyclohexylcarbamoyl)phenyl]-2,4-dimethylbenzamide.

Molecular Properties

Compound NameN-[2-(cyclohexylcarbamoyl)phenyl]-2,4-dimethylbenzamide
PubChem CID100720174
Molecular FormulaC22H26N2O2
Molecular Weight350.46 g/mol
Exact Mass350.20
IUPAC NameN-[2-(cyclohexylcarbamoyl)phenyl]-2,4-dimethylbenzamide
SMILESCc1ccc(C(=O)Nc2ccccc2C(=O)NC2CCCCC2)c(C)c1
InChIInChI=1S/C22H26N2O2/c1-15-12-13-18(16(2)14-15)21(25)24-20-11-7-6-10-19(20)22(26)23-17-8-4-3-5-9-17/h6-7,10-14,17H,3-5,8-9H2,1-2H3,(H,23,26)(H,24,25)
InChIKeyVUSPRFKMMACCRW-UHFFFAOYSA-N
XLogP4.62
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 54.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclododecyl-2,4-dimethylbenzamide
CID 19656258
N-[2-(cyclohexylcarbamoyl)phenyl]-3-[(2,4-dimethylphenyl)sulfamoyl]-4-methylbenzamide
CID 126413886
N-cyclohexyl-2-[[(2S)-2-(2,4-dimethylphenoxy)propanoyl]amino]benzamide
CID 9180227
N-cyclohexyl-2,5-dimethylbenzamide
CID 925443
N-(azepan-4-yl)-2,4-dimethylbenzamide
CID 105058394
methyl 4-[[2-(cyclohexylcarbamoyl)phenyl]carbamoyl]benzoate
CID 17178227
2,4-dimethyl-N-[2-(propylcarbamoyl)phenyl]benzamide
CID 34748509
N-cyclohexyl-2-[(2-ethoxybenzoyl)amino]benzamide
CID 4926381
N-cyclohexyl-2-[[2-(4-methylphenoxy)acetyl]amino]benzamide
CID 1226844
2-[[2-[N-(benzenesulfonyl)-2,4-dimethylanilino]acetyl]amino]-N-cyclohexylbenzamide
CID 126035099
N-cyclopropyl-2-[[2-(2,5-dimethylanilino)acetyl]amino]benzamide
CID 17498144
N-cyclopentyl-2-[[2-(2-methylphenyl)acetyl]amino]benzamide
CID 17476217

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclohexylcarbamoyl)phenyl]-2,4-dimethylbenzamide?
The IUPAC name of N-[2-(cyclohexylcarbamoyl)phenyl]-2,4-dimethylbenzamide (CID 100720174) is N-[2-(cyclohexylcarbamoyl)phenyl]-2,4-dimethylbenzamide.
What is the SMILES notation for N-[2-(cyclohexylcarbamoyl)phenyl]-2,4-dimethylbenzamide?
The canonical SMILES for N-[2-(cyclohexylcarbamoyl)phenyl]-2,4-dimethylbenzamide is Cc1ccc(C(=O)Nc2ccccc2C(=O)NC2CCCCC2)c(C)c1.
What is the InChIKey of N-[2-(cyclohexylcarbamoyl)phenyl]-2,4-dimethylbenzamide?
The InChIKey is VUSPRFKMMACCRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O2/c1-15-12-13-18(16(2)14-15)21(25)24-20-11-7-6-10-19(20)22(26)23-17-8-4-3-5-9-17/h6-7,10-14,17H,3-5,8-9H2,1-2H3,(H,23,26)(H,24,25).
What are the key properties of N-[2-(cyclohexylcarbamoyl)phenyl]-2,4-dimethylbenzamide?
N-[2-(cyclohexylcarbamoyl)phenyl]-2,4-dimethylbenzamide has a molecular weight of 350.46 g/mol, XLogP of 4.62, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclohexylcarbamoyl)phenyl]-2,4-dimethylbenzamide is sourced from PubChem (CID 100720174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).