2-cyclohexyl-N,2-dimethyl-N-[2-(3-methylphenyl)-2-oxoethyl]propanamide

C20H29NO2 — CID 118603514

IUPAC2-cyclohexyl-N,2-dimethyl-N-[2-(3-methylphenyl)-2-oxoethyl]propanamide
SMILESCc1cccc(C(=O)CN(C)C(=O)C(C)(C)C2CCCCC2)c1
InChIInChI=1S/C20H29NO2/c1-15-9-8-10-16(13-15)18(22)14-21(4)19(23)20(2,3)17-11-6-5-7-12-17/h8-10,13,17H,5-7,11-12,14H2,1-4H3
InChIKeyWHBNRRUMEHBGLJ-UHFFFAOYSA-N
MW315.46 g/mol
LogP4.24
Rot. Bonds5

About 2-cyclohexyl-N,2-dimethyl-N-[2-(3-methylphenyl)-2-oxoethyl]propanamide

2-cyclohexyl-N,2-dimethyl-N-[2-(3-methylphenyl)-2-oxoethyl]propanamide (PubChem CID 118603514) has the molecular formula C20H29NO2 and a molecular weight of 315.46 g/mol. Its IUPAC name is 2-cyclohexyl-N,2-dimethyl-N-[2-(3-methylphenyl)-2-oxoethyl]propanamide.

Molecular Properties

Compound Name2-cyclohexyl-N,2-dimethyl-N-[2-(3-methylphenyl)-2-oxoethyl]propanamide
PubChem CID118603514
Molecular FormulaC20H29NO2
Molecular Weight315.46 g/mol
Exact Mass315.22
IUPAC Name2-cyclohexyl-N,2-dimethyl-N-[2-(3-methylphenyl)-2-oxoethyl]propanamide
SMILESCc1cccc(C(=O)CN(C)C(=O)C(C)(C)C2CCCCC2)c1
InChIInChI=1S/C20H29NO2/c1-15-9-8-10-16(13-15)18(22)14-21(4)19(23)20(2,3)17-11-6-5-7-12-17/h8-10,13,17H,5-7,11-12,14H2,1-4H3
InChIKeyWHBNRRUMEHBGLJ-UHFFFAOYSA-N
XLogP4.24
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.46
LogP ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-cyclohexyl-N,2-dimethyl-N-[2-(3-methylphenyl)-2-oxoethyl]propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-cyclohexyl-N-[2-(4-methoxyphenyl)-2-oxoethyl]-N,2-dimethylpropanamide
CID 78324505
2-cyclohexyl-N,2-dimethyl-N-(2-oxo-2-thiophen-3-ylethyl)propanamide
CID 78323587
2-cyclohexyl-N,2-dimethyl-N-(2-oxo-2-pyridin-2-ylethyl)propanamide
CID 78324506
N-[2-cyclohexylpropan-2-yl(methyl)carbamoyl]-N-[2-(3-methylphenyl)-2-oxoethyl]formamide
CID 138510349
2-[3,3-dimethylbutan-2-yl(methyl)amino]-1-(3-methylphenyl)ethanone
CID 55010786
3-[cyclopropylmethyl(methyl)amino]-1-(3-methylphenyl)propan-1-one
CID 62630543
1-(3-methylphenyl)-2-[methyl(2,2,2-trifluoroethyl)amino]ethanone
CID 60892938
2-[cyclopropyl(2-hydroxyethyl)amino]-1-(3-methylphenyl)ethanone
CID 62030145
2-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]-1-(3-methylphenyl)ethanone
CID 79319620
N-[2-[cyclohexyl(methyl)amino]ethyl]-3-methylbenzamide
CID 121420012
N-methyl-2-[methyl-[2-(3-methylphenyl)-2-oxoethyl]amino]acetamide
CID 62051984
1-cyclopentyl-2-(N,3-dimethylanilino)ethanone
CID 104750297

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-N,2-dimethyl-N-[2-(3-methylphenyl)-2-oxoethyl]propanamide?
The IUPAC name of 2-cyclohexyl-N,2-dimethyl-N-[2-(3-methylphenyl)-2-oxoethyl]propanamide (CID 118603514) is 2-cyclohexyl-N,2-dimethyl-N-[2-(3-methylphenyl)-2-oxoethyl]propanamide.
What is the SMILES notation for 2-cyclohexyl-N,2-dimethyl-N-[2-(3-methylphenyl)-2-oxoethyl]propanamide?
The canonical SMILES for 2-cyclohexyl-N,2-dimethyl-N-[2-(3-methylphenyl)-2-oxoethyl]propanamide is Cc1cccc(C(=O)CN(C)C(=O)C(C)(C)C2CCCCC2)c1.
What is the InChIKey of 2-cyclohexyl-N,2-dimethyl-N-[2-(3-methylphenyl)-2-oxoethyl]propanamide?
The InChIKey is WHBNRRUMEHBGLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29NO2/c1-15-9-8-10-16(13-15)18(22)14-21(4)19(23)20(2,3)17-11-6-5-7-12-17/h8-10,13,17H,5-7,11-12,14H2,1-4H3.
What are the key properties of 2-cyclohexyl-N,2-dimethyl-N-[2-(3-methylphenyl)-2-oxoethyl]propanamide?
2-cyclohexyl-N,2-dimethyl-N-[2-(3-methylphenyl)-2-oxoethyl]propanamide has a molecular weight of 315.46 g/mol, XLogP of 4.24, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-N,2-dimethyl-N-[2-(3-methylphenyl)-2-oxoethyl]propanamide is sourced from PubChem (CID 118603514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).