(3S)-3-methylcyclopentene

C6H10 — CID 11018803

IUPAC(3S)-3-methylcyclopentene
SMILESC[C@@H]1C=CCC1
InChIInChI=1S/C6H10/c1-6-4-2-3-5-6/h2,4,6H,3,5H2,1H3/t6-/m1/s1
InChIKeyCXOZQHPXKPDQGT-ZCFIWIBFSA-N
MW82.15 g/mol
LogP1.97
Rot. Bonds

About (3S)-3-methylcyclopentene

(3S)-3-methylcyclopentene (PubChem CID 11018803) has the molecular formula C6H10 and a molecular weight of 82.15 g/mol. Its IUPAC name is (3S)-3-methylcyclopentene.

Molecular Properties

Compound Name(3S)-3-methylcyclopentene
PubChem CID11018803
Molecular FormulaC6H10
Molecular Weight82.15 g/mol
Exact Mass82.08
IUPAC Name(3S)-3-methylcyclopentene
SMILESC[C@@H]1C=CCC1
InChIInChI=1S/C6H10/c1-6-4-2-3-5-6/h2,4,6H,3,5H2,1H3/t6-/m1/s1
InChIKeyCXOZQHPXKPDQGT-ZCFIWIBFSA-N
XLogP1.97
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50082.15
LogP ≤ 51.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze (3S)-3-methylcyclopentene 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 (3S)-3-methylcyclopentene?
The IUPAC name of (3S)-3-methylcyclopentene (CID 11018803) is (3S)-3-methylcyclopentene.
What is the SMILES notation for (3S)-3-methylcyclopentene?
The canonical SMILES for (3S)-3-methylcyclopentene is C[C@@H]1C=CCC1.
What is the InChIKey of (3S)-3-methylcyclopentene?
The InChIKey is CXOZQHPXKPDQGT-ZCFIWIBFSA-N. The full InChI is InChI=1S/C6H10/c1-6-4-2-3-5-6/h2,4,6H,3,5H2,1H3/t6-/m1/s1.
What are the key properties of (3S)-3-methylcyclopentene?
(3S)-3-methylcyclopentene has a molecular weight of 82.15 g/mol, XLogP of 1.97, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-methylcyclopentene is sourced from PubChem (CID 11018803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).