(1-cyclopentylsulfonyl-5-methylpyrrolidin-3-yl)methanamine

C11H22N2O2S — CID 105361446

IUPAC(1-cyclopentylsulfonyl-5-methylpyrrolidin-3-yl)methanamine
SMILESCC1CC(CN)CN1S(=O)(=O)C1CCCC1
InChIInChI=1S/C11H22N2O2S/c1-9-6-10(7-12)8-13(9)16(14,15)11-4-2-3-5-11/h9-11H,2-8,12H2,1H3
InChIKeyWBXFKLQUHYUYJG-UHFFFAOYSA-N
MW246.38 g/mol
LogP0.93
Rot. Bonds3

About (1-cyclopentylsulfonyl-5-methylpyrrolidin-3-yl)methanamine

(1-cyclopentylsulfonyl-5-methylpyrrolidin-3-yl)methanamine (PubChem CID 105361446) has the molecular formula C11H22N2O2S and a molecular weight of 246.38 g/mol. Its IUPAC name is (1-cyclopentylsulfonyl-5-methylpyrrolidin-3-yl)methanamine.

Molecular Properties

Compound Name(1-cyclopentylsulfonyl-5-methylpyrrolidin-3-yl)methanamine
PubChem CID105361446
Molecular FormulaC11H22N2O2S
Molecular Weight246.38 g/mol
Exact Mass246.14
IUPAC Name(1-cyclopentylsulfonyl-5-methylpyrrolidin-3-yl)methanamine
SMILESCC1CC(CN)CN1S(=O)(=O)C1CCCC1
InChIInChI=1S/C11H22N2O2S/c1-9-6-10(7-12)8-13(9)16(14,15)11-4-2-3-5-11/h9-11H,2-8,12H2,1H3
InChIKeyWBXFKLQUHYUYJG-UHFFFAOYSA-N
XLogP0.93
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.38
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (1-cyclopentylsulfonyl-5-methylpyrrolidin-3-yl)methanamine 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 (1-cyclopentylsulfonyl-5-methylpyrrolidin-3-yl)methanamine?
The IUPAC name of (1-cyclopentylsulfonyl-5-methylpyrrolidin-3-yl)methanamine (CID 105361446) is (1-cyclopentylsulfonyl-5-methylpyrrolidin-3-yl)methanamine.
What is the SMILES notation for (1-cyclopentylsulfonyl-5-methylpyrrolidin-3-yl)methanamine?
The canonical SMILES for (1-cyclopentylsulfonyl-5-methylpyrrolidin-3-yl)methanamine is CC1CC(CN)CN1S(=O)(=O)C1CCCC1.
What is the InChIKey of (1-cyclopentylsulfonyl-5-methylpyrrolidin-3-yl)methanamine?
The InChIKey is WBXFKLQUHYUYJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2S/c1-9-6-10(7-12)8-13(9)16(14,15)11-4-2-3-5-11/h9-11H,2-8,12H2,1H3.
What are the key properties of (1-cyclopentylsulfonyl-5-methylpyrrolidin-3-yl)methanamine?
(1-cyclopentylsulfonyl-5-methylpyrrolidin-3-yl)methanamine has a molecular weight of 246.38 g/mol, XLogP of 0.93, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-cyclopentylsulfonyl-5-methylpyrrolidin-3-yl)methanamine is sourced from PubChem (CID 105361446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).