N-(2-cyclohexylsulfonylethyl)propan-2-amine

C11H23NO2S — CID 64676192

IUPACN-(2-cyclohexylsulfonylethyl)propan-2-amine
SMILESCC(C)NCCS(=O)(=O)C1CCCCC1
InChIInChI=1S/C11H23NO2S/c1-10(2)12-8-9-15(13,14)11-6-4-3-5-7-11/h10-12H,3-9H2,1-2H3
InChIKeyCTROVJQCGXSVEJ-UHFFFAOYSA-N
MW233.38 g/mol
LogP1.73
Rot. Bonds5

About N-(2-cyclohexylsulfonylethyl)propan-2-amine

N-(2-cyclohexylsulfonylethyl)propan-2-amine (PubChem CID 64676192) has the molecular formula C11H23NO2S and a molecular weight of 233.38 g/mol. Its IUPAC name is N-(2-cyclohexylsulfonylethyl)propan-2-amine.

Molecular Properties

Compound NameN-(2-cyclohexylsulfonylethyl)propan-2-amine
PubChem CID64676192
Molecular FormulaC11H23NO2S
Molecular Weight233.38 g/mol
Exact Mass233.14
IUPAC NameN-(2-cyclohexylsulfonylethyl)propan-2-amine
SMILESCC(C)NCCS(=O)(=O)C1CCCCC1
InChIInChI=1S/C11H23NO2S/c1-10(2)12-8-9-15(13,14)11-6-4-3-5-7-11/h10-12H,3-9H2,1-2H3
InChIKeyCTROVJQCGXSVEJ-UHFFFAOYSA-N
XLogP1.73
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.38
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(2-cyclohexylsulfonylethyl)propan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexylsulfonylethyl)propan-2-amine?
The IUPAC name of N-(2-cyclohexylsulfonylethyl)propan-2-amine (CID 64676192) is N-(2-cyclohexylsulfonylethyl)propan-2-amine.
What is the SMILES notation for N-(2-cyclohexylsulfonylethyl)propan-2-amine?
The canonical SMILES for N-(2-cyclohexylsulfonylethyl)propan-2-amine is CC(C)NCCS(=O)(=O)C1CCCCC1.
What is the InChIKey of N-(2-cyclohexylsulfonylethyl)propan-2-amine?
The InChIKey is CTROVJQCGXSVEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2S/c1-10(2)12-8-9-15(13,14)11-6-4-3-5-7-11/h10-12H,3-9H2,1-2H3.
What are the key properties of N-(2-cyclohexylsulfonylethyl)propan-2-amine?
N-(2-cyclohexylsulfonylethyl)propan-2-amine has a molecular weight of 233.38 g/mol, XLogP of 1.73, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexylsulfonylethyl)propan-2-amine is sourced from PubChem (CID 64676192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).