2-(4-chloro-2-methoxyphenyl)-N-(4-methylcyclohexyl)acetamide

C16H22ClNO2 — CID 69039877

IUPAC2-(4-chloro-2-methoxyphenyl)-N-(4-methylcyclohexyl)acetamide
SMILESCOc1cc(Cl)ccc1CC(=O)NC1CCC(C)CC1
InChIInChI=1S/C16H22ClNO2/c1-11-3-7-14(8-4-11)18-16(19)9-12-5-6-13(17)10-15(12)20-2/h5-6,10-11,14H,3-4,7-9H2,1-2H3,(H,18,19)
InChIKeyXIPLAALADBQCGU-UHFFFAOYSA-N
MW295.81 g/mol
LogP3.59
Rot. Bonds4

About 2-(4-chloro-2-methoxyphenyl)-N-(4-methylcyclohexyl)acetamide

2-(4-chloro-2-methoxyphenyl)-N-(4-methylcyclohexyl)acetamide (PubChem CID 69039877) has the molecular formula C16H22ClNO2 and a molecular weight of 295.81 g/mol. Its IUPAC name is 2-(4-chloro-2-methoxyphenyl)-N-(4-methylcyclohexyl)acetamide.

Molecular Properties

Compound Name2-(4-chloro-2-methoxyphenyl)-N-(4-methylcyclohexyl)acetamide
PubChem CID69039877
Molecular FormulaC16H22ClNO2
Molecular Weight295.81 g/mol
Exact Mass295.13
IUPAC Name2-(4-chloro-2-methoxyphenyl)-N-(4-methylcyclohexyl)acetamide
SMILESCOc1cc(Cl)ccc1CC(=O)NC1CCC(C)CC1
InChIInChI=1S/C16H22ClNO2/c1-11-3-7-14(8-4-11)18-16(19)9-12-5-6-13(17)10-15(12)20-2/h5-6,10-11,14H,3-4,7-9H2,1-2H3,(H,18,19)
InChIKeyXIPLAALADBQCGU-UHFFFAOYSA-N
XLogP3.59
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.81
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(4-chloro-2-methoxyphenyl)-N-(4-methylcyclohexyl)acetamide 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-(4-chloro-2-fluorophenyl)-N-cyclopropylacetamide
CID 56920036
N-cyclopentyl-2-(2,4-dimethoxyphenyl)acetamide
CID 17474203
2-(4-bromo-2-methoxyphenyl)-N-cyclobutylacetamide
CID 155293567
2-(2-chloro-4-methoxyphenyl)-N-cyclopropylacetamide
CID 110769934
[2-[(4-methylcyclohexyl)amino]-2-oxoethyl] 4-chloro-2-hydroxybenzoate
CID 7500066
N-[(4-chloro-2-methoxyphenyl)methyl]-N'-cyclopropylethane-1,2-diamine
CID 113405316
N-cyclopentyl-2-(4-ethenyl-2-methoxyphenyl)acetamide
CID 176516245
2-[(4-chloro-2-methylphenyl)methylamino]-N-cyclopropylacetamide
CID 113461466
1-[(4-chloro-2-methoxyphenyl)methyl]-3-[(3S)-1,1-dioxothiolan-3-yl]urea
CID 95334613
2-(5-chloro-2-methoxyphenyl)-N-[(1S,2S)-2-methylcyclohexyl]acetamide
CID 9084409
N-(4-aminocyclohexyl)-2-(2,4-dichlorophenyl)acetamide;hydrochloride
CID 119474323
(2S,4S)-N-[(4-chloro-2-methoxyphenyl)methyl]-2-methylpiperidine-4-carboxamide
CID 120631755

Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-2-methoxyphenyl)-N-(4-methylcyclohexyl)acetamide?
The IUPAC name of 2-(4-chloro-2-methoxyphenyl)-N-(4-methylcyclohexyl)acetamide (CID 69039877) is 2-(4-chloro-2-methoxyphenyl)-N-(4-methylcyclohexyl)acetamide.
What is the SMILES notation for 2-(4-chloro-2-methoxyphenyl)-N-(4-methylcyclohexyl)acetamide?
The canonical SMILES for 2-(4-chloro-2-methoxyphenyl)-N-(4-methylcyclohexyl)acetamide is COc1cc(Cl)ccc1CC(=O)NC1CCC(C)CC1.
What is the InChIKey of 2-(4-chloro-2-methoxyphenyl)-N-(4-methylcyclohexyl)acetamide?
The InChIKey is XIPLAALADBQCGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22ClNO2/c1-11-3-7-14(8-4-11)18-16(19)9-12-5-6-13(17)10-15(12)20-2/h5-6,10-11,14H,3-4,7-9H2,1-2H3,(H,18,19).
What are the key properties of 2-(4-chloro-2-methoxyphenyl)-N-(4-methylcyclohexyl)acetamide?
2-(4-chloro-2-methoxyphenyl)-N-(4-methylcyclohexyl)acetamide has a molecular weight of 295.81 g/mol, XLogP of 3.59, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chloro-2-methoxyphenyl)-N-(4-methylcyclohexyl)acetamide is sourced from PubChem (CID 69039877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).