1-cyclopentylbutane-1-sulfonamide

C9H19NO2S — CID 165443509

IUPAC1-cyclopentylbutane-1-sulfonamide
SMILESCCCC(C1CCCC1)S(N)(=O)=O
InChIInChI=1S/C9H19NO2S/c1-2-5-9(13(10,11)12)8-6-3-4-7-8/h8-9H,2-7H2,1H3,(H2,10,11,12)
InChIKeySJAHPNXBHXJSEW-UHFFFAOYSA-N
MW205.32 g/mol
LogP1.63
Rot. Bonds4

About 1-cyclopentylbutane-1-sulfonamide

1-cyclopentylbutane-1-sulfonamide (PubChem CID 165443509) has the molecular formula C9H19NO2S and a molecular weight of 205.32 g/mol. Its IUPAC name is 1-cyclopentylbutane-1-sulfonamide.

Molecular Properties

Compound Name1-cyclopentylbutane-1-sulfonamide
PubChem CID165443509
Molecular FormulaC9H19NO2S
Molecular Weight205.32 g/mol
Exact Mass205.11
IUPAC Name1-cyclopentylbutane-1-sulfonamide
SMILESCCCC(C1CCCC1)S(N)(=O)=O
InChIInChI=1S/C9H19NO2S/c1-2-5-9(13(10,11)12)8-6-3-4-7-8/h8-9H,2-7H2,1H3,(H2,10,11,12)
InChIKeySJAHPNXBHXJSEW-UHFFFAOYSA-N
XLogP1.63
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.32
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-cyclopentylbutane-1-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 1-cyclopentylbutane-1-sulfonamide?
The IUPAC name of 1-cyclopentylbutane-1-sulfonamide (CID 165443509) is 1-cyclopentylbutane-1-sulfonamide.
What is the SMILES notation for 1-cyclopentylbutane-1-sulfonamide?
The canonical SMILES for 1-cyclopentylbutane-1-sulfonamide is CCCC(C1CCCC1)S(N)(=O)=O.
What is the InChIKey of 1-cyclopentylbutane-1-sulfonamide?
The InChIKey is SJAHPNXBHXJSEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2S/c1-2-5-9(13(10,11)12)8-6-3-4-7-8/h8-9H,2-7H2,1H3,(H2,10,11,12).
What are the key properties of 1-cyclopentylbutane-1-sulfonamide?
1-cyclopentylbutane-1-sulfonamide has a molecular weight of 205.32 g/mol, XLogP of 1.63, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentylbutane-1-sulfonamide is sourced from PubChem (CID 165443509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).