N-(2-methylcyclohexyl)-4-phenylaniline

C19H23N — CID 43716847

IUPACN-(2-methylcyclohexyl)-4-phenylaniline
SMILESCC1CCCCC1Nc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C19H23N/c1-15-7-5-6-10-19(15)20-18-13-11-17(12-14-18)16-8-3-2-4-9-16/h2-4,8-9,11-15,19-20H,5-7,10H2,1H3
InChIKeyAGQUCQKNYMAHEO-UHFFFAOYSA-N
MW265.40 g/mol
LogP5.34
Rot. Bonds3

About N-(2-methylcyclohexyl)-4-phenylaniline

N-(2-methylcyclohexyl)-4-phenylaniline (PubChem CID 43716847) has the molecular formula C19H23N and a molecular weight of 265.40 g/mol. Its IUPAC name is N-(2-methylcyclohexyl)-4-phenylaniline.

Molecular Properties

Compound NameN-(2-methylcyclohexyl)-4-phenylaniline
PubChem CID43716847
Molecular FormulaC19H23N
Molecular Weight265.40 g/mol
Exact Mass265.18
IUPAC NameN-(2-methylcyclohexyl)-4-phenylaniline
SMILESCC1CCCCC1Nc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C19H23N/c1-15-7-5-6-10-19(15)20-18-13-11-17(12-14-18)16-8-3-2-4-9-16/h2-4,8-9,11-15,19-20H,5-7,10H2,1H3
InChIKeyAGQUCQKNYMAHEO-UHFFFAOYSA-N
XLogP5.34
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500265.40
LogP ≤ 55.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2,6-dimethylcyclohexyl)-4-phenylaniline
CID 43716849
2-N-(4-phenylphenyl)cyclohexane-1,2-diamine
CID 115117777
1-N-(4-phenylphenyl)cyclopentane-1,2-diamine
CID 115117122
4-fluoro-N-[(1R,2S)-2-methylcyclopentyl]aniline
CID 96923123
cis-(1R,2S)-1-N,2-N-diphenylcyclohexane-1,2-diamine
CID 142660752
4-[(2-methylcyclohexyl)amino]benzonitrile
CID 43178854
4-cyclopentylsulfanyl-N-(2-methylcyclohexyl)aniline
CID 43726302
N-(2-methylcyclohexyl)-4-(1,3,4-oxadiazol-2-yl)aniline
CID 43206385
N-(2-methylcyclohexyl)-4-nitroaniline
CID 43079076
N-(2-methylcyclopentyl)pyridin-4-amine
CID 63281266
4-N-(2-methylcyclohexyl)benzene-1,2,4-triamine
CID 106750255
2-(4-phenylanilino)cyclobutane-1-carboxylic acid
CID 103230394

Frequently Asked Questions

What is the IUPAC name of N-(2-methylcyclohexyl)-4-phenylaniline?
The IUPAC name of N-(2-methylcyclohexyl)-4-phenylaniline (CID 43716847) is N-(2-methylcyclohexyl)-4-phenylaniline.
What is the SMILES notation for N-(2-methylcyclohexyl)-4-phenylaniline?
The canonical SMILES for N-(2-methylcyclohexyl)-4-phenylaniline is CC1CCCCC1Nc1ccc(-c2ccccc2)cc1.
What is the InChIKey of N-(2-methylcyclohexyl)-4-phenylaniline?
The InChIKey is AGQUCQKNYMAHEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N/c1-15-7-5-6-10-19(15)20-18-13-11-17(12-14-18)16-8-3-2-4-9-16/h2-4,8-9,11-15,19-20H,5-7,10H2,1H3.
What are the key properties of N-(2-methylcyclohexyl)-4-phenylaniline?
N-(2-methylcyclohexyl)-4-phenylaniline has a molecular weight of 265.40 g/mol, XLogP of 5.34, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylcyclohexyl)-4-phenylaniline is sourced from PubChem (CID 43716847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).