1,2-bis(pent-1-ynyl)cyclopentene

C15H20 — CID 11127301

IUPAC1,2-bis(pent-1-ynyl)cyclopentene
SMILESCCCC#CC1=C(C#CCCC)CCC1
InChIInChI=1S/C15H20/c1-3-5-7-10-14-12-9-13-15(14)11-8-6-4-2/h3-6,9,12-13H2,1-2H3
InChIKeyUODXXZZYFIBFHG-UHFFFAOYSA-N
MW200.32 g/mol
LogP4.07
Rot. Bonds2

About 1,2-bis(pent-1-ynyl)cyclopentene

1,2-bis(pent-1-ynyl)cyclopentene (PubChem CID 11127301) has the molecular formula C15H20 and a molecular weight of 200.32 g/mol. Its IUPAC name is 1,2-bis(pent-1-ynyl)cyclopentene.

Molecular Properties

Compound Name1,2-bis(pent-1-ynyl)cyclopentene
PubChem CID11127301
Molecular FormulaC15H20
Molecular Weight200.32 g/mol
Exact Mass200.16
IUPAC Name1,2-bis(pent-1-ynyl)cyclopentene
SMILESCCCC#CC1=C(C#CCCC)CCC1
InChIInChI=1S/C15H20/c1-3-5-7-10-14-12-9-13-15(14)11-8-6-4-2/h3-6,9,12-13H2,1-2H3
InChIKeyUODXXZZYFIBFHG-UHFFFAOYSA-N
XLogP4.07
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.32
LogP ≤ 54.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 1,2-bis(pent-1-ynyl)cyclopentene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-Octene, 2,3-dimethyl-
CID 140599
2-Methyl-3-ethyl-2-heptene
CID 140589
Diethylcyclopentene
CID 53658550
4,5-Dipropyl-4-octene
CID 143530
Cyclopentene, 1-butyl-2-methyl
CID 6427723
4-Ethyl-3-methyloct-3-ene
CID 123273790
Cyclopentene, 1-methyl-2-propyl
CID 523539
1-Ethyl-2-propylcyclopentene
CID 91001233
1-Methyl-2-oct-1-ynylcyclobutene
CID 10773623
1-Oct-1-ynylcyclopentene
CID 10910108
1-Ethynyl-2-prop-1-ynylcyclopentene
CID 11297985
1,2-Diethynylcyclopent-1-ene
CID 11400748

Frequently Asked Questions

What is the IUPAC name of 1,2-bis(pent-1-ynyl)cyclopentene?
The IUPAC name of 1,2-bis(pent-1-ynyl)cyclopentene (CID 11127301) is 1,2-bis(pent-1-ynyl)cyclopentene.
What is the SMILES notation for 1,2-bis(pent-1-ynyl)cyclopentene?
The canonical SMILES for 1,2-bis(pent-1-ynyl)cyclopentene is CCCC#CC1=C(C#CCCC)CCC1.
What is the InChIKey of 1,2-bis(pent-1-ynyl)cyclopentene?
The InChIKey is UODXXZZYFIBFHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20/c1-3-5-7-10-14-12-9-13-15(14)11-8-6-4-2/h3-6,9,12-13H2,1-2H3.
What are the key properties of 1,2-bis(pent-1-ynyl)cyclopentene?
1,2-bis(pent-1-ynyl)cyclopentene has a molecular weight of 200.32 g/mol, XLogP of 4.07, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-bis(pent-1-ynyl)cyclopentene is sourced from PubChem (CID 11127301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).