(1Z)-1,2-dimethylcyclohexadecene

C18H34 — CID 134982655

IUPAC(1Z)-1,2-dimethylcyclohexadecene
SMILESC/C1=C(\C)CCCCCCCCCCCCCC1
InChIInChI=1S/C18H34/c1-17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18(17)2/h3-16H2,1-2H3/b18-17-
InChIKeyGJWZIUZWPDWAJA-ZCXUNETKSA-N
MW250.47 g/mol
LogP6.80
Rot. Bonds

About (1Z)-1,2-dimethylcyclohexadecene

(1Z)-1,2-dimethylcyclohexadecene (PubChem CID 134982655) has the molecular formula C18H34 and a molecular weight of 250.47 g/mol. Its IUPAC name is (1Z)-1,2-dimethylcyclohexadecene.

Molecular Properties

Compound Name(1Z)-1,2-dimethylcyclohexadecene
PubChem CID134982655
Molecular FormulaC18H34
Molecular Weight250.47 g/mol
Exact Mass250.27
IUPAC Name(1Z)-1,2-dimethylcyclohexadecene
SMILESC/C1=C(\C)CCCCCCCCCCCCCC1
InChIInChI=1S/C18H34/c1-17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18(17)2/h3-16H2,1-2H3/b18-17-
InChIKeyGJWZIUZWPDWAJA-ZCXUNETKSA-N
XLogP6.80
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500250.47
LogP ≤ 56.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze (1Z)-1,2-dimethylcyclohexadecene 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-dimethylcyclohexadecene?
The IUPAC name of (1Z)-1,2-dimethylcyclohexadecene (CID 134982655) is (1Z)-1,2-dimethylcyclohexadecene.
What is the SMILES notation for (1Z)-1,2-dimethylcyclohexadecene?
The canonical SMILES for (1Z)-1,2-dimethylcyclohexadecene is C/C1=C(\C)CCCCCCCCCCCCCC1.
What is the InChIKey of (1Z)-1,2-dimethylcyclohexadecene?
The InChIKey is GJWZIUZWPDWAJA-ZCXUNETKSA-N. The full InChI is InChI=1S/C18H34/c1-17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18(17)2/h3-16H2,1-2H3/b18-17-.
What are the key properties of (1Z)-1,2-dimethylcyclohexadecene?
(1Z)-1,2-dimethylcyclohexadecene has a molecular weight of 250.47 g/mol, XLogP of 6.80, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z)-1,2-dimethylcyclohexadecene is sourced from PubChem (CID 134982655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).