N-(3-amino-4-methylphenyl)-2-cyclohexylacetamide

C15H22N2O — CID 43209699

IUPACN-(3-amino-4-methylphenyl)-2-cyclohexylacetamide
SMILESCc1ccc(NC(=O)CC2CCCCC2)cc1N
InChIInChI=1S/C15H22N2O/c1-11-7-8-13(10-14(11)16)17-15(18)9-12-5-3-2-4-6-12/h7-8,10,12H,2-6,9,16H2,1H3,(H,17,18)
InChIKeyLYVSEJHNEIYDON-UHFFFAOYSA-N
MW246.35 g/mol
LogP3.49
Rot. Bonds3

About N-(3-amino-4-methylphenyl)-2-cyclohexylacetamide

N-(3-amino-4-methylphenyl)-2-cyclohexylacetamide (PubChem CID 43209699) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is N-(3-amino-4-methylphenyl)-2-cyclohexylacetamide.

Molecular Properties

Compound NameN-(3-amino-4-methylphenyl)-2-cyclohexylacetamide
PubChem CID43209699
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC NameN-(3-amino-4-methylphenyl)-2-cyclohexylacetamide
SMILESCc1ccc(NC(=O)CC2CCCCC2)cc1N
InChIInChI=1S/C15H22N2O/c1-11-7-8-13(10-14(11)16)17-15(18)9-12-5-3-2-4-6-12/h7-8,10,12H,2-6,9,16H2,1H3,(H,17,18)
InChIKeyLYVSEJHNEIYDON-UHFFFAOYSA-N
XLogP3.49
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 53.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(3-amino-4-ethylphenyl)-2-cyclohexylacetamide
CID 43550224
N-(3-amino-4-methylphenyl)-2-[cyclopentyl(methyl)amino]acetamide
CID 43375929
N-(4-bromo-3-methylphenyl)-2-cyclopentylacetamide
CID 2679466
N-(3-amino-4-fluorophenyl)-2-cyclobutylacetamide
CID 103805248
5-[(2-cyclobutylacetyl)amino]-2-methylbenzoic acid
CID 113352851
N-[3-(3-aminoprop-1-ynyl)-4-methylphenyl]-2-cyclohexylacetamide
CID 63333889
N-(3-amino-4-methylphenyl)-2-cyclopentylsulfinylacetamide
CID 63115433
2-amino-N-(3-amino-4-methylphenyl)acetamide
CID 146654157
2-cyclopentyl-N-(3,4-dimethoxyphenyl)acetamide
CID 2682853
2-cyclohexyl-N-(4-iodophenyl)acetamide
CID 807079
N-(2-amino-4-bromo-6-methylphenyl)-2-cycloheptylacetamide
CID 114457042
N-(3-amino-4-methylphenyl)-2-[cyclopropylmethyl(ethyl)amino]acetamide
CID 63954898

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-4-methylphenyl)-2-cyclohexylacetamide?
The IUPAC name of N-(3-amino-4-methylphenyl)-2-cyclohexylacetamide (CID 43209699) is N-(3-amino-4-methylphenyl)-2-cyclohexylacetamide.
What is the SMILES notation for N-(3-amino-4-methylphenyl)-2-cyclohexylacetamide?
The canonical SMILES for N-(3-amino-4-methylphenyl)-2-cyclohexylacetamide is Cc1ccc(NC(=O)CC2CCCCC2)cc1N.
What is the InChIKey of N-(3-amino-4-methylphenyl)-2-cyclohexylacetamide?
The InChIKey is LYVSEJHNEIYDON-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-11-7-8-13(10-14(11)16)17-15(18)9-12-5-3-2-4-6-12/h7-8,10,12H,2-6,9,16H2,1H3,(H,17,18).
What are the key properties of N-(3-amino-4-methylphenyl)-2-cyclohexylacetamide?
N-(3-amino-4-methylphenyl)-2-cyclohexylacetamide has a molecular weight of 246.35 g/mol, XLogP of 3.49, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-4-methylphenyl)-2-cyclohexylacetamide is sourced from PubChem (CID 43209699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).