1,2-di(propan-2-yl)cyclopentene

C11H20 — CID 22965805

IUPAC1,2-di(propan-2-yl)cyclopentene
SMILESCC(C)C1=C(C(C)C)CCC1
InChIInChI=1S/C11H20/c1-8(2)10-6-5-7-11(10)9(3)4/h8-9H,5-7H2,1-4H3
InChIKeyMNRCBSCOBIWSJO-UHFFFAOYSA-N
MW152.28 g/mol
LogP3.78
Rot. Bonds2

About 1,2-di(propan-2-yl)cyclopentene

1,2-di(propan-2-yl)cyclopentene (PubChem CID 22965805) has the molecular formula C11H20 and a molecular weight of 152.28 g/mol. Its IUPAC name is 1,2-di(propan-2-yl)cyclopentene.

Molecular Properties

Compound Name1,2-di(propan-2-yl)cyclopentene
PubChem CID22965805
Molecular FormulaC11H20
Molecular Weight152.28 g/mol
Exact Mass152.16
IUPAC Name1,2-di(propan-2-yl)cyclopentene
SMILESCC(C)C1=C(C(C)C)CCC1
InChIInChI=1S/C11H20/c1-8(2)10-6-5-7-11(10)9(3)4/h8-9H,5-7H2,1-4H3
InChIKeyMNRCBSCOBIWSJO-UHFFFAOYSA-N
XLogP3.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.28
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 1,2-di(propan-2-yl)cyclopentene 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 1,2-di(propan-2-yl)cyclopentene?
The IUPAC name of 1,2-di(propan-2-yl)cyclopentene (CID 22965805) is 1,2-di(propan-2-yl)cyclopentene.
What is the SMILES notation for 1,2-di(propan-2-yl)cyclopentene?
The canonical SMILES for 1,2-di(propan-2-yl)cyclopentene is CC(C)C1=C(C(C)C)CCC1.
What is the InChIKey of 1,2-di(propan-2-yl)cyclopentene?
The InChIKey is MNRCBSCOBIWSJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20/c1-8(2)10-6-5-7-11(10)9(3)4/h8-9H,5-7H2,1-4H3.
What are the key properties of 1,2-di(propan-2-yl)cyclopentene?
1,2-di(propan-2-yl)cyclopentene has a molecular weight of 152.28 g/mol, XLogP of 3.78, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-di(propan-2-yl)cyclopentene is sourced from PubChem (CID 22965805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).