N-(1-cyclohexylethyl)-3-methylaniline

C15H23N — CID 43755613

IUPACN-(1-cyclohexylethyl)-3-methylaniline
SMILESCc1cccc(NC(C)C2CCCCC2)c1
InChIInChI=1S/C15H23N/c1-12-7-6-10-15(11-12)16-13(2)14-8-4-3-5-9-14/h6-7,10-11,13-14,16H,3-5,8-9H2,1-2H3
InChIKeyCMDIWFNJISWLDM-UHFFFAOYSA-N
MW217.36 g/mol
LogP4.38
Rot. Bonds3

About N-(1-cyclohexylethyl)-3-methylaniline

N-(1-cyclohexylethyl)-3-methylaniline (PubChem CID 43755613) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is N-(1-cyclohexylethyl)-3-methylaniline.

Molecular Properties

Compound NameN-(1-cyclohexylethyl)-3-methylaniline
PubChem CID43755613
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC NameN-(1-cyclohexylethyl)-3-methylaniline
SMILESCc1cccc(NC(C)C2CCCCC2)c1
InChIInChI=1S/C15H23N/c1-12-7-6-10-15(11-12)16-13(2)14-8-4-3-5-9-14/h6-7,10-11,13-14,16H,3-5,8-9H2,1-2H3
InChIKeyCMDIWFNJISWLDM-UHFFFAOYSA-N
XLogP4.38
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-(1-cyclohexylethyl)-3-methylaniline 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

3-chloro-N-(1-cyclohexylethyl)aniline
CID 43762066
3-bromo-N-(1-cyclohexylethyl)-4-methylaniline
CID 55192209
N-(1-cyclopentylethyl)-3-pyrrolidin-1-ylaniline
CID 62632471
2-cyclohexyl-2-(3-methylanilino)acetamide
CID 54892215
N-(1-cyclopentylethyl)-3,4-dimethylaniline
CID 62634053
N-(1-cyclobutylethyl)aniline
CID 58933203
2-bromo-N-(1-cyclohexylethyl)-5-methylaniline
CID 82762032
N-(1-cyclopentylethyl)-3-(4-methyl-1,2,4-triazol-3-yl)aniline
CID 62634097
N-(1-cyclohexylethyl)-2,4-dimethylaniline
CID 43755727
N-(1-cyclopentylethyl)-5-methylpyridin-3-amine
CID 115922263
3-bromo-N-(1-cyclohexylethyl)-4-fluoroaniline
CID 113451928
2,6-dibromo-N-(1-cyclohexylethyl)-4-methylaniline
CID 55199408

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclohexylethyl)-3-methylaniline?
The IUPAC name of N-(1-cyclohexylethyl)-3-methylaniline (CID 43755613) is N-(1-cyclohexylethyl)-3-methylaniline.
What is the SMILES notation for N-(1-cyclohexylethyl)-3-methylaniline?
The canonical SMILES for N-(1-cyclohexylethyl)-3-methylaniline is Cc1cccc(NC(C)C2CCCCC2)c1.
What is the InChIKey of N-(1-cyclohexylethyl)-3-methylaniline?
The InChIKey is CMDIWFNJISWLDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c1-12-7-6-10-15(11-12)16-13(2)14-8-4-3-5-9-14/h6-7,10-11,13-14,16H,3-5,8-9H2,1-2H3.
What are the key properties of N-(1-cyclohexylethyl)-3-methylaniline?
N-(1-cyclohexylethyl)-3-methylaniline has a molecular weight of 217.36 g/mol, XLogP of 4.38, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclohexylethyl)-3-methylaniline is sourced from PubChem (CID 43755613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).