4-(3-cyclopentylpropyl)cyclopentene

C13H22 — CID 148933494

IUPAC4-(3-cyclopentylpropyl)cyclopentene
SMILESC1=CCC(CCCC2CCCC2)C1
InChIInChI=1S/C13H22/c1-2-7-12(6-1)10-5-11-13-8-3-4-9-13/h1-2,12-13H,3-11H2
InChIKeyPMKDJSHZZCMIQK-UHFFFAOYSA-N
MW178.32 g/mol
LogP4.31
Rot. Bonds4

About 4-(3-cyclopentylpropyl)cyclopentene

4-(3-cyclopentylpropyl)cyclopentene (PubChem CID 148933494) has the molecular formula C13H22 and a molecular weight of 178.32 g/mol. Its IUPAC name is 4-(3-cyclopentylpropyl)cyclopentene.

Molecular Properties

Compound Name4-(3-cyclopentylpropyl)cyclopentene
PubChem CID148933494
Molecular FormulaC13H22
Molecular Weight178.32 g/mol
Exact Mass178.17
IUPAC Name4-(3-cyclopentylpropyl)cyclopentene
SMILESC1=CCC(CCCC2CCCC2)C1
InChIInChI=1S/C13H22/c1-2-7-12(6-1)10-5-11-13-8-3-4-9-13/h1-2,12-13H,3-11H2
InChIKeyPMKDJSHZZCMIQK-UHFFFAOYSA-N
XLogP4.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.32
LogP ≤ 54.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

3-cyclohexadecylpropylcyclohexadecane
CID 57270632
3-cyclobutylpropylcyclohexane
CID 54165208
4-cyclopentylbutylcyclohexane
CID 144547696
4,4,4-trifluorobutylcyclopentane
CID 149313516
5-cyclobutylpentylcyclobutane
CID 173228999
3-iodopropylcyclopentane
CID 15508337
4-hexylcyclopentene
CID 10487053
5-(5-cyclopentylpentyl)cyclohexa-1,3-diene
CID 142426678
1-(cyclohexylmethyl)-4-(4-cyclopropylbutyl)cyclohexane
CID 168781110
4-hex-5-enylcyclopentene
CID 154064369
5-chloropentylcyclopentane
CID 91621144
4-cycloheptylbutan-1-ol
CID 54439965

Frequently Asked Questions

What is the IUPAC name of 4-(3-cyclopentylpropyl)cyclopentene?
The IUPAC name of 4-(3-cyclopentylpropyl)cyclopentene (CID 148933494) is 4-(3-cyclopentylpropyl)cyclopentene.
What is the SMILES notation for 4-(3-cyclopentylpropyl)cyclopentene?
The canonical SMILES for 4-(3-cyclopentylpropyl)cyclopentene is C1=CCC(CCCC2CCCC2)C1.
What is the InChIKey of 4-(3-cyclopentylpropyl)cyclopentene?
The InChIKey is PMKDJSHZZCMIQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22/c1-2-7-12(6-1)10-5-11-13-8-3-4-9-13/h1-2,12-13H,3-11H2.
What are the key properties of 4-(3-cyclopentylpropyl)cyclopentene?
4-(3-cyclopentylpropyl)cyclopentene has a molecular weight of 178.32 g/mol, XLogP of 4.31, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-cyclopentylpropyl)cyclopentene is sourced from PubChem (CID 148933494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).