N-(2-chlorophenyl)-2-[(3-methylcyclohexyl)amino]acetamide

C15H21ClN2O — CID 43317886

IUPACN-(2-chlorophenyl)-2-[(3-methylcyclohexyl)amino]acetamide
SMILESCC1CCCC(NCC(=O)Nc2ccccc2Cl)C1
InChIInChI=1S/C15H21ClN2O/c1-11-5-4-6-12(9-11)17-10-15(19)18-14-8-3-2-7-13(14)16/h2-3,7-8,11-12,17H,4-6,9-10H2,1H3,(H,18,19)
InChIKeyCBKGQLJDIBJQAJ-UHFFFAOYSA-N
MW280.80 g/mol
LogP3.45
Rot. Bonds4

About N-(2-chlorophenyl)-2-[(3-methylcyclohexyl)amino]acetamide

N-(2-chlorophenyl)-2-[(3-methylcyclohexyl)amino]acetamide (PubChem CID 43317886) has the molecular formula C15H21ClN2O and a molecular weight of 280.80 g/mol. Its IUPAC name is N-(2-chlorophenyl)-2-[(3-methylcyclohexyl)amino]acetamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-2-[(3-methylcyclohexyl)amino]acetamide
PubChem CID43317886
Molecular FormulaC15H21ClN2O
Molecular Weight280.80 g/mol
Exact Mass280.13
IUPAC NameN-(2-chlorophenyl)-2-[(3-methylcyclohexyl)amino]acetamide
SMILESCC1CCCC(NCC(=O)Nc2ccccc2Cl)C1
InChIInChI=1S/C15H21ClN2O/c1-11-5-4-6-12(9-11)17-10-15(19)18-14-8-3-2-7-13(14)16/h2-3,7-8,11-12,17H,4-6,9-10H2,1H3,(H,18,19)
InChIKeyCBKGQLJDIBJQAJ-UHFFFAOYSA-N
XLogP3.45
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.80
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-chlorophenyl)-2-[(1-methylpyrrolidin-3-yl)amino]acetamide
CID 54950079
N-(2-chlorophenyl)-2-[(2-methyloxolan-3-yl)amino]acetamide
CID 82725585
N-[2-(2-chloroanilino)-2-oxoethyl]cyclobutanecarboxamide
CID 112997775
2-[[(1R,3S)-3-methylcyclohexyl]amino]-1-phenylethanone
CID 122534357
N-(3-fluorophenyl)-2-[(3-methylcyclohexyl)amino]acetamide
CID 43317890
N'-(2-chlorophenyl)-N-cyclopentylpropanediamide
CID 108942228
N-(2-bromophenyl)-2-[(3-ethylcyclohexyl)amino]acetamide
CID 64743584
2-(cyclopentylamino)-N-(2,4-dichlorophenyl)acetamide
CID 9465920
N-cyclohexyl-2-[(3-methylcyclohexyl)amino]acetamide
CID 43317870
(2S,6S)-N-(2-chlorophenyl)-2,6-dimethylpiperidine-1-carboxamide
CID 41097747
2-chloro-6-[[(3-methylcyclohexyl)amino]methyl]phenol
CID 112554031
2-(cyclopentylamino)-N-[2-(dimethylamino)phenyl]acetamide
CID 60849441

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-2-[(3-methylcyclohexyl)amino]acetamide?
The IUPAC name of N-(2-chlorophenyl)-2-[(3-methylcyclohexyl)amino]acetamide (CID 43317886) is N-(2-chlorophenyl)-2-[(3-methylcyclohexyl)amino]acetamide.
What is the SMILES notation for N-(2-chlorophenyl)-2-[(3-methylcyclohexyl)amino]acetamide?
The canonical SMILES for N-(2-chlorophenyl)-2-[(3-methylcyclohexyl)amino]acetamide is CC1CCCC(NCC(=O)Nc2ccccc2Cl)C1.
What is the InChIKey of N-(2-chlorophenyl)-2-[(3-methylcyclohexyl)amino]acetamide?
The InChIKey is CBKGQLJDIBJQAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21ClN2O/c1-11-5-4-6-12(9-11)17-10-15(19)18-14-8-3-2-7-13(14)16/h2-3,7-8,11-12,17H,4-6,9-10H2,1H3,(H,18,19).
What are the key properties of N-(2-chlorophenyl)-2-[(3-methylcyclohexyl)amino]acetamide?
N-(2-chlorophenyl)-2-[(3-methylcyclohexyl)amino]acetamide has a molecular weight of 280.80 g/mol, XLogP of 3.45, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-2-[(3-methylcyclohexyl)amino]acetamide is sourced from PubChem (CID 43317886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).