1-(5-methyltridecyl)cyclopentene

C19H36 — CID 142058433

IUPAC1-(5-methyltridecyl)cyclopentene
SMILESCCCCCCCCC(C)CCCCC1=CCCC1
InChIInChI=1S/C19H36/c1-3-4-5-6-7-8-13-18(2)14-9-10-15-19-16-11-12-17-19/h16,18H,3-15,17H2,1-2H3
InChIKeyFVBXAVILLGZRCU-UHFFFAOYSA-N
MW264.50 g/mol
LogP7.04
Rot. Bonds12

About 1-(5-methyltridecyl)cyclopentene

1-(5-methyltridecyl)cyclopentene (PubChem CID 142058433) has the molecular formula C19H36 and a molecular weight of 264.50 g/mol. Its IUPAC name is 1-(5-methyltridecyl)cyclopentene.

Molecular Properties

Compound Name1-(5-methyltridecyl)cyclopentene
PubChem CID142058433
Molecular FormulaC19H36
Molecular Weight264.50 g/mol
Exact Mass264.28
IUPAC Name1-(5-methyltridecyl)cyclopentene
SMILESCCCCCCCCC(C)CCCCC1=CCCC1
InChIInChI=1S/C19H36/c1-3-4-5-6-7-8-13-18(2)14-9-10-15-19-16-11-12-17-19/h16,18H,3-15,17H2,1-2H3
InChIKeyFVBXAVILLGZRCU-UHFFFAOYSA-N
XLogP7.04
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds12
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500264.50
LogP ≤ 57.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1-octylcyclohexene
CID 519088
1-hexylcycloheptene
CID 15587826
1-nonylcyclooctene
CID 151486862
1-pentylcyclododecene
CID 150654776
1-[4-(cyclopenten-1-yl)butyl]cyclopentene
CID 10420053
1-hexylcyclobutene
CID 86205685
1-octadec-9-enylcyclohexene
CID 123690376
1-butylcyclononene
CID 56981158
N-[2-(cyclopenten-1-yl)ethyl]dodecan-1-amine
CID 106173944
N-[2-(cyclopenten-1-yl)ethyl]pentan-1-amine
CID 103096944
10,16-dimethyldotriacontane
CID 91748795
6-methyloctacosane
CID 22223942

Frequently Asked Questions

What is the IUPAC name of 1-(5-methyltridecyl)cyclopentene?
The IUPAC name of 1-(5-methyltridecyl)cyclopentene (CID 142058433) is 1-(5-methyltridecyl)cyclopentene.
What is the SMILES notation for 1-(5-methyltridecyl)cyclopentene?
The canonical SMILES for 1-(5-methyltridecyl)cyclopentene is CCCCCCCCC(C)CCCCC1=CCCC1.
What is the InChIKey of 1-(5-methyltridecyl)cyclopentene?
The InChIKey is FVBXAVILLGZRCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H36/c1-3-4-5-6-7-8-13-18(2)14-9-10-15-19-16-11-12-17-19/h16,18H,3-15,17H2,1-2H3.
What are the key properties of 1-(5-methyltridecyl)cyclopentene?
1-(5-methyltridecyl)cyclopentene has a molecular weight of 264.50 g/mol, XLogP of 7.04, 12 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methyltridecyl)cyclopentene is sourced from PubChem (CID 142058433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).