N-(2,4-dichlorophenyl)-2-[(2-methylcyclohexyl)amino]propanamide

C16H22Cl2N2O — CID 78636184

IUPACN-(2,4-dichlorophenyl)-2-[(2-methylcyclohexyl)amino]propanamide
SMILESCC(NC1CCCCC1C)C(=O)Nc1ccc(Cl)cc1Cl
InChIInChI=1S/C16H22Cl2N2O/c1-10-5-3-4-6-14(10)19-11(2)16(21)20-15-8-7-12(17)9-13(15)18/h7-11,14,19H,3-6H2,1-2H3,(H,20,21)
InChIKeyWMWLZVXOSWQMQF-UHFFFAOYSA-N
MW329.27 g/mol
LogP4.49
Rot. Bonds4

About N-(2,4-dichlorophenyl)-2-[(2-methylcyclohexyl)amino]propanamide

N-(2,4-dichlorophenyl)-2-[(2-methylcyclohexyl)amino]propanamide (PubChem CID 78636184) has the molecular formula C16H22Cl2N2O and a molecular weight of 329.27 g/mol. Its IUPAC name is N-(2,4-dichlorophenyl)-2-[(2-methylcyclohexyl)amino]propanamide.

Molecular Properties

Compound NameN-(2,4-dichlorophenyl)-2-[(2-methylcyclohexyl)amino]propanamide
PubChem CID78636184
Molecular FormulaC16H22Cl2N2O
Molecular Weight329.27 g/mol
Exact Mass328.11
IUPAC NameN-(2,4-dichlorophenyl)-2-[(2-methylcyclohexyl)amino]propanamide
SMILESCC(NC1CCCCC1C)C(=O)Nc1ccc(Cl)cc1Cl
InChIInChI=1S/C16H22Cl2N2O/c1-10-5-3-4-6-14(10)19-11(2)16(21)20-15-8-7-12(17)9-13(15)18/h7-11,14,19H,3-6H2,1-2H3,(H,20,21)
InChIKeyWMWLZVXOSWQMQF-UHFFFAOYSA-N
XLogP4.49
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.27
LogP ≤ 54.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(2,4-dichlorophenyl)-2-[(2-methylcyclohexyl)amino]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

1-(2,4-dichlorophenyl)-3-(2-methylcyclohexyl)thiourea
CID 4020555
(2S)-2-[[(1R,2R,3R)-2,3-dimethylcyclohexyl]amino]-N-(2,3,4-trifluorophenyl)propanamide
CID 11939545
N-(4-ethylphenyl)-2-[(2-methylcyclohexyl)amino]propanamide
CID 112768865
[(1S)-1-(2,4-dichlorophenyl)ethyl]-[2-[[(1R,2R)-2-methylcyclohexyl]amino]-2-oxoethyl]azanium
CID 8594454
1-N-(2,4-dichlorophenyl)-4-N-propan-2-ylcyclohexane-1,4-dicarboxamide
CID 109144629
(2R)-N-(2,4-dichlorophenyl)-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]propanamide
CID 98319171
(2R)-N-(5-chloro-2-methoxyphenyl)-2-(cyclooctylamino)propanamide
CID 7509630
(2R)-N-(5-chloro-2-methoxyphenyl)-2-(cyclohexylamino)propanamide
CID 40602408
N-[1-(2,5-dichlorophenyl)ethyl]-2-methylcyclopentan-1-amine
CID 55193924
N-cyclopropyl-2-(2,4-dichloroanilino)propanamide
CID 43085964
N-(2,4-dichlorophenyl)-3-methylpiperidine-1-carboxamide
CID 4591854
(2S)-2-(4-acetylpiperazin-1-yl)-N-(2,4-dichlorophenyl)propanamide
CID 2690225

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dichlorophenyl)-2-[(2-methylcyclohexyl)amino]propanamide?
The IUPAC name of N-(2,4-dichlorophenyl)-2-[(2-methylcyclohexyl)amino]propanamide (CID 78636184) is N-(2,4-dichlorophenyl)-2-[(2-methylcyclohexyl)amino]propanamide.
What is the SMILES notation for N-(2,4-dichlorophenyl)-2-[(2-methylcyclohexyl)amino]propanamide?
The canonical SMILES for N-(2,4-dichlorophenyl)-2-[(2-methylcyclohexyl)amino]propanamide is CC(NC1CCCCC1C)C(=O)Nc1ccc(Cl)cc1Cl.
What is the InChIKey of N-(2,4-dichlorophenyl)-2-[(2-methylcyclohexyl)amino]propanamide?
The InChIKey is WMWLZVXOSWQMQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22Cl2N2O/c1-10-5-3-4-6-14(10)19-11(2)16(21)20-15-8-7-12(17)9-13(15)18/h7-11,14,19H,3-6H2,1-2H3,(H,20,21).
What are the key properties of N-(2,4-dichlorophenyl)-2-[(2-methylcyclohexyl)amino]propanamide?
N-(2,4-dichlorophenyl)-2-[(2-methylcyclohexyl)amino]propanamide has a molecular weight of 329.27 g/mol, XLogP of 4.49, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dichlorophenyl)-2-[(2-methylcyclohexyl)amino]propanamide is sourced from PubChem (CID 78636184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).