2-[(4-ethylcyclohexyl)methylamino]-N-(3-methylphenyl)acetamide

C18H28N2O — CID 60972732

IUPAC2-[(4-ethylcyclohexyl)methylamino]-N-(3-methylphenyl)acetamide
SMILESCCC1CCC(CNCC(=O)Nc2cccc(C)c2)CC1
InChIInChI=1S/C18H28N2O/c1-3-15-7-9-16(10-8-15)12-19-13-18(21)20-17-6-4-5-14(2)11-17/h4-6,11,15-16,19H,3,7-10,12-13H2,1-2H3,(H,20,21)
InChIKeyUUFKRSGLDUCVOR-UHFFFAOYSA-N
MW288.44 g/mol
LogP3.74
Rot. Bonds6

About 2-[(4-ethylcyclohexyl)methylamino]-N-(3-methylphenyl)acetamide

2-[(4-ethylcyclohexyl)methylamino]-N-(3-methylphenyl)acetamide (PubChem CID 60972732) has the molecular formula C18H28N2O and a molecular weight of 288.44 g/mol. Its IUPAC name is 2-[(4-ethylcyclohexyl)methylamino]-N-(3-methylphenyl)acetamide.

Molecular Properties

Compound Name2-[(4-ethylcyclohexyl)methylamino]-N-(3-methylphenyl)acetamide
PubChem CID60972732
Molecular FormulaC18H28N2O
Molecular Weight288.44 g/mol
Exact Mass288.22
IUPAC Name2-[(4-ethylcyclohexyl)methylamino]-N-(3-methylphenyl)acetamide
SMILESCCC1CCC(CNCC(=O)Nc2cccc(C)c2)CC1
InChIInChI=1S/C18H28N2O/c1-3-15-7-9-16(10-8-15)12-19-13-18(21)20-17-6-4-5-14(2)11-17/h4-6,11,15-16,19H,3,7-10,12-13H2,1-2H3,(H,20,21)
InChIKeyUUFKRSGLDUCVOR-UHFFFAOYSA-N
XLogP3.74
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.44
LogP ≤ 53.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-[(4-ethylcyclohexyl)methylamino]-N-(3-methylphenyl)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-(cyclopropylmethylamino)-N-(3-fluorophenyl)acetamide
CID 28566886
2-(2-cyclopentylethylamino)-N-(3-methylphenyl)acetamide
CID 54932599
N-(3-bromophenyl)-2-[(4-hydroxycyclohexyl)methylamino]acetamide
CID 106133334
N-(4-ethylcyclohexyl)-N'-(3-methylphenyl)oxamide
CID 124505061
2-(cyclopropylmethylamino)-N-(3,4-dimethylphenyl)acetamide;hydrochloride
CID 119670640
2-(cyclopropylmethylamino)-N-(4-methylphenyl)acetamide
CID 28566911
2-[(3-ethylcyclohexyl)amino]-N-(3-methylphenyl)acetamide
CID 64742409
2-(cyclopropylmethylamino)-N-[3-(difluoromethyl)phenyl]acetamide;hydrochloride
CID 119767750
2-(cyclopropylmethylamino)-N-(3-pyrrolidin-1-ylphenyl)acetamide
CID 60928462
2-(cyclopropylmethylamino)-N-[3-(2-methoxyethoxy)phenyl]acetamide;hydrochloride
CID 119723471
2-[4-(methylaminomethyl)piperidin-1-yl]-N-(3-methylphenyl)acetamide
CID 63248780
2-(cyclopropylmethylamino)-N-[3-(1-ethyltetrazol-5-yl)phenyl]acetamide;hydrochloride
CID 119795053

Frequently Asked Questions

What is the IUPAC name of 2-[(4-ethylcyclohexyl)methylamino]-N-(3-methylphenyl)acetamide?
The IUPAC name of 2-[(4-ethylcyclohexyl)methylamino]-N-(3-methylphenyl)acetamide (CID 60972732) is 2-[(4-ethylcyclohexyl)methylamino]-N-(3-methylphenyl)acetamide.
What is the SMILES notation for 2-[(4-ethylcyclohexyl)methylamino]-N-(3-methylphenyl)acetamide?
The canonical SMILES for 2-[(4-ethylcyclohexyl)methylamino]-N-(3-methylphenyl)acetamide is CCC1CCC(CNCC(=O)Nc2cccc(C)c2)CC1.
What is the InChIKey of 2-[(4-ethylcyclohexyl)methylamino]-N-(3-methylphenyl)acetamide?
The InChIKey is UUFKRSGLDUCVOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O/c1-3-15-7-9-16(10-8-15)12-19-13-18(21)20-17-6-4-5-14(2)11-17/h4-6,11,15-16,19H,3,7-10,12-13H2,1-2H3,(H,20,21).
What are the key properties of 2-[(4-ethylcyclohexyl)methylamino]-N-(3-methylphenyl)acetamide?
2-[(4-ethylcyclohexyl)methylamino]-N-(3-methylphenyl)acetamide has a molecular weight of 288.44 g/mol, XLogP of 3.74, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-ethylcyclohexyl)methylamino]-N-(3-methylphenyl)acetamide is sourced from PubChem (CID 60972732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).