(1Z)-1,2-dibutylcycloundecene

C19H36 — CID 24974250

IUPAC(1Z)-1,2-dibutylcycloundecene
SMILESCCCC/C1=C(\CCCC)CCCCCCCCC1
InChIInChI=1S/C19H36/c1-3-5-14-18-16-12-10-8-7-9-11-13-17-19(18)15-6-4-2/h3-17H2,1-2H3/b19-18-
InChIKeyOGJQPTBIZDVZEW-HNENSFHCSA-N
MW264.50 g/mol
LogP7.19
Rot. Bonds6

About (1Z)-1,2-dibutylcycloundecene

(1Z)-1,2-dibutylcycloundecene (PubChem CID 24974250) has the molecular formula C19H36 and a molecular weight of 264.50 g/mol. Its IUPAC name is (1Z)-1,2-dibutylcycloundecene.

Molecular Properties

Compound Name(1Z)-1,2-dibutylcycloundecene
PubChem CID24974250
Molecular FormulaC19H36
Molecular Weight264.50 g/mol
Exact Mass264.28
IUPAC Name(1Z)-1,2-dibutylcycloundecene
SMILESCCCC/C1=C(\CCCC)CCCCCCCCC1
InChIInChI=1S/C19H36/c1-3-5-14-18-16-12-10-8-7-9-11-13-17-19(18)15-6-4-2/h3-17H2,1-2H3/b19-18-
InChIKeyOGJQPTBIZDVZEW-HNENSFHCSA-N
XLogP7.19
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500264.50
LogP ≤ 57.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze (1Z)-1,2-dibutylcycloundecene 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

Cyclopentene, 1-ethyl-2-methyl-
CID 88243
1,2-Dimethylcyclohexene
CID 15480
Cyclohexene, 1-ethyl-2-methyl-
CID 88242
Cembrene C
CID 14336535
8-Heptadecene, 9-octyl-
CID 292287
2-Heptene, 2,3-dimethyl-
CID 137816
2-Octene, 2,3-dimethyl-
CID 140599
Cycloheptene, 1,2-dimethyl-
CID 519742
Bicyclo[7.7.0]hexadec-1(9)-ene
CID 534882
5,6-Dibutyl-dec-5-ene
CID 11807167
1-Hexadecyl-cyclopentene
CID 19000578
1-Dodecyl-cyclopentene
CID 54360767

Frequently Asked Questions

What is the IUPAC name of (1Z)-1,2-dibutylcycloundecene?
The IUPAC name of (1Z)-1,2-dibutylcycloundecene (CID 24974250) is (1Z)-1,2-dibutylcycloundecene.
What is the SMILES notation for (1Z)-1,2-dibutylcycloundecene?
The canonical SMILES for (1Z)-1,2-dibutylcycloundecene is CCCC/C1=C(\CCCC)CCCCCCCCC1.
What is the InChIKey of (1Z)-1,2-dibutylcycloundecene?
The InChIKey is OGJQPTBIZDVZEW-HNENSFHCSA-N. The full InChI is InChI=1S/C19H36/c1-3-5-14-18-16-12-10-8-7-9-11-13-17-19(18)15-6-4-2/h3-17H2,1-2H3/b19-18-.
What are the key properties of (1Z)-1,2-dibutylcycloundecene?
(1Z)-1,2-dibutylcycloundecene has a molecular weight of 264.50 g/mol, XLogP of 7.19, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z)-1,2-dibutylcycloundecene is sourced from PubChem (CID 24974250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).