2-cyclohexyl-N-(2-methylsulfanylethyl)ethanamine

C11H23NS — CID 12017335

IUPAC2-cyclohexyl-N-(2-methylsulfanylethyl)ethanamine
SMILESCSCCNCCC1CCCCC1
InChIInChI=1S/C11H23NS/c1-13-10-9-12-8-7-11-5-3-2-4-6-11/h11-12H,2-10H2,1H3
InChIKeyBYZHTMIALZBJLJ-UHFFFAOYSA-N
MW201.38 g/mol
LogP2.91
Rot. Bonds6

About 2-cyclohexyl-N-(2-methylsulfanylethyl)ethanamine

2-cyclohexyl-N-(2-methylsulfanylethyl)ethanamine (PubChem CID 12017335) has the molecular formula C11H23NS and a molecular weight of 201.38 g/mol. Its IUPAC name is 2-cyclohexyl-N-(2-methylsulfanylethyl)ethanamine.

Molecular Properties

Compound Name2-cyclohexyl-N-(2-methylsulfanylethyl)ethanamine
PubChem CID12017335
Molecular FormulaC11H23NS
Molecular Weight201.38 g/mol
Exact Mass201.16
IUPAC Name2-cyclohexyl-N-(2-methylsulfanylethyl)ethanamine
SMILESCSCCNCCC1CCCCC1
InChIInChI=1S/C11H23NS/c1-13-10-9-12-8-7-11-5-3-2-4-6-11/h11-12H,2-10H2,1H3
InChIKeyBYZHTMIALZBJLJ-UHFFFAOYSA-N
XLogP2.91
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.38
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-cyclohexyl-N-(2-methylsulfanylethyl)ethanamine 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

2-cyclohexyl-N-(2-methylsulfanylethyl)ethanamine;hydrochloride
CID 22723059
2-methylsulfanylethylcyclohexane
CID 14024904
2-(2-cycloheptylethylamino)ethanol
CID 22723010
N-(2-cyclohexylethyl)butan-1-amine;hydrochloride
CID 57440786
2-cyclononyl-N-(cyclononylmethyl)ethanamine
CID 91347612
N-(cyclobutylmethyl)-2-cyclohexylethanamine
CID 65457561
2-cyclopentyl-N-ethylethanamine;hydrochloride
CID 3028141
N'-(2-cyclopentylethyl)ethane-1,2-diamine
CID 57274460
3-(2-cycloheptylethylamino)propan-1-ol
CID 114457835
2-(2-cyclopentylethylamino)ethanol;hydrochloride
CID 22723115
2-cyclobutyl-N-(2-piperidin-4-ylsulfanylethyl)ethanamine
CID 114628849
(2S)-2-amino-N-(2-cyclohexylethyl)-4-methylsulfanylbutanamide
CID 61178313

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-N-(2-methylsulfanylethyl)ethanamine?
The IUPAC name of 2-cyclohexyl-N-(2-methylsulfanylethyl)ethanamine (CID 12017335) is 2-cyclohexyl-N-(2-methylsulfanylethyl)ethanamine.
What is the SMILES notation for 2-cyclohexyl-N-(2-methylsulfanylethyl)ethanamine?
The canonical SMILES for 2-cyclohexyl-N-(2-methylsulfanylethyl)ethanamine is CSCCNCCC1CCCCC1.
What is the InChIKey of 2-cyclohexyl-N-(2-methylsulfanylethyl)ethanamine?
The InChIKey is BYZHTMIALZBJLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NS/c1-13-10-9-12-8-7-11-5-3-2-4-6-11/h11-12H,2-10H2,1H3.
What are the key properties of 2-cyclohexyl-N-(2-methylsulfanylethyl)ethanamine?
2-cyclohexyl-N-(2-methylsulfanylethyl)ethanamine has a molecular weight of 201.38 g/mol, XLogP of 2.91, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-N-(2-methylsulfanylethyl)ethanamine is sourced from PubChem (CID 12017335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).