N-(2-aminophenyl)-3-cyclohexyl-2-methylpropanamide

C16H24N2O — CID 119422452

IUPACN-(2-aminophenyl)-3-cyclohexyl-2-methylpropanamide
SMILESCC(CC1CCCCC1)C(=O)Nc1ccccc1N
InChIInChI=1S/C16H24N2O/c1-12(11-13-7-3-2-4-8-13)16(19)18-15-10-6-5-9-14(15)17/h5-6,9-10,12-13H,2-4,7-8,11,17H2,1H3,(H,18,19)
InChIKeyUMSDRLVLIAICAS-UHFFFAOYSA-N
MW260.38 g/mol
LogP3.81
Rot. Bonds4

About N-(2-aminophenyl)-3-cyclohexyl-2-methylpropanamide

N-(2-aminophenyl)-3-cyclohexyl-2-methylpropanamide (PubChem CID 119422452) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is N-(2-aminophenyl)-3-cyclohexyl-2-methylpropanamide.

Molecular Properties

Compound NameN-(2-aminophenyl)-3-cyclohexyl-2-methylpropanamide
PubChem CID119422452
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC NameN-(2-aminophenyl)-3-cyclohexyl-2-methylpropanamide
SMILESCC(CC1CCCCC1)C(=O)Nc1ccccc1N
InChIInChI=1S/C16H24N2O/c1-12(11-13-7-3-2-4-8-13)16(19)18-15-10-6-5-9-14(15)17/h5-6,9-10,12-13H,2-4,7-8,11,17H2,1H3,(H,18,19)
InChIKeyUMSDRLVLIAICAS-UHFFFAOYSA-N
XLogP3.81
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 53.81
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

3-cyclopentyl-N-[2-(ethylaminomethyl)phenyl]-2-methylpropanamide
CID 119439505
N-(5-amino-2-methylphenyl)-3-cyclohexyl-2-methylpropanamide
CID 120569231
N-(2-aminophenyl)-3-cyclohexylbutanamide;hydrochloride
CID 119422685
N-(6-amino-1,3-benzodioxol-5-yl)-3-cyclopentyl-2-methylpropanamide;hydrochloride
CID 119618365
N-(2-aminophenyl)-2-cyclopentylacetamide;hydrochloride
CID 119259903
N-(2-aminophenyl)-2-cyclobutyloxypropanamide
CID 62116312
N-(2-aminophenyl)-2-[1-cyclopropylethyl(methyl)amino]propanamide
CID 43568725
(3R)-3-amino-4-cyclohexyl-2-hydroxy-N-(2-methylphenyl)butanamide
CID 70065939
(2R)-2-amino-N-(2-aminophenyl)propanamide;hydrochloride
CID 131153716
N-(3-aminopropyl)-3-cyclohexyl-2-methylpropanamide
CID 119407411
[1-(2-aminoanilino)-1-oxopropan-2-yl] acetate
CID 167409598
N-(2-aminophenyl)-4-[cyclohexyl(methyl)amino]butanamide
CID 16794531

Frequently Asked Questions

What is the IUPAC name of N-(2-aminophenyl)-3-cyclohexyl-2-methylpropanamide?
The IUPAC name of N-(2-aminophenyl)-3-cyclohexyl-2-methylpropanamide (CID 119422452) is N-(2-aminophenyl)-3-cyclohexyl-2-methylpropanamide.
What is the SMILES notation for N-(2-aminophenyl)-3-cyclohexyl-2-methylpropanamide?
The canonical SMILES for N-(2-aminophenyl)-3-cyclohexyl-2-methylpropanamide is CC(CC1CCCCC1)C(=O)Nc1ccccc1N.
What is the InChIKey of N-(2-aminophenyl)-3-cyclohexyl-2-methylpropanamide?
The InChIKey is UMSDRLVLIAICAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-12(11-13-7-3-2-4-8-13)16(19)18-15-10-6-5-9-14(15)17/h5-6,9-10,12-13H,2-4,7-8,11,17H2,1H3,(H,18,19).
What are the key properties of N-(2-aminophenyl)-3-cyclohexyl-2-methylpropanamide?
N-(2-aminophenyl)-3-cyclohexyl-2-methylpropanamide has a molecular weight of 260.38 g/mol, XLogP of 3.81, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminophenyl)-3-cyclohexyl-2-methylpropanamide is sourced from PubChem (CID 119422452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).