N-(cyclohexylmethyl)propane-2-sulfonamide

C10H21NO2S — CID 61360832

IUPACN-(cyclohexylmethyl)propane-2-sulfonamide
SMILESCC(C)S(=O)(=O)NCC1CCCCC1
InChIInChI=1S/C10H21NO2S/c1-9(2)14(12,13)11-8-10-6-4-3-5-7-10/h9-11H,3-8H2,1-2H3
InChIKeySTCDRKLKUTUMQV-UHFFFAOYSA-N
MW219.35 g/mol
LogP1.89
Rot. Bonds4

About N-(cyclohexylmethyl)propane-2-sulfonamide

N-(cyclohexylmethyl)propane-2-sulfonamide (PubChem CID 61360832) has the molecular formula C10H21NO2S and a molecular weight of 219.35 g/mol. Its IUPAC name is N-(cyclohexylmethyl)propane-2-sulfonamide.

Molecular Properties

Compound NameN-(cyclohexylmethyl)propane-2-sulfonamide
PubChem CID61360832
Molecular FormulaC10H21NO2S
Molecular Weight219.35 g/mol
Exact Mass219.13
IUPAC NameN-(cyclohexylmethyl)propane-2-sulfonamide
SMILESCC(C)S(=O)(=O)NCC1CCCCC1
InChIInChI=1S/C10H21NO2S/c1-9(2)14(12,13)11-8-10-6-4-3-5-7-10/h9-11H,3-8H2,1-2H3
InChIKeySTCDRKLKUTUMQV-UHFFFAOYSA-N
XLogP1.89
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.35
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(cyclohexylmethyl)propane-2-sulfonamide 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-(cyclohexylmethyl)propane-2-sulfonamide?
The IUPAC name of N-(cyclohexylmethyl)propane-2-sulfonamide (CID 61360832) is N-(cyclohexylmethyl)propane-2-sulfonamide.
What is the SMILES notation for N-(cyclohexylmethyl)propane-2-sulfonamide?
The canonical SMILES for N-(cyclohexylmethyl)propane-2-sulfonamide is CC(C)S(=O)(=O)NCC1CCCCC1.
What is the InChIKey of N-(cyclohexylmethyl)propane-2-sulfonamide?
The InChIKey is STCDRKLKUTUMQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2S/c1-9(2)14(12,13)11-8-10-6-4-3-5-7-10/h9-11H,3-8H2,1-2H3.
What are the key properties of N-(cyclohexylmethyl)propane-2-sulfonamide?
N-(cyclohexylmethyl)propane-2-sulfonamide has a molecular weight of 219.35 g/mol, XLogP of 1.89, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)propane-2-sulfonamide is sourced from PubChem (CID 61360832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).