(1Z)-1,2-dimethylcyclodocosene

C24H46 — CID 134982656

IUPAC(1Z)-1,2-dimethylcyclodocosene
SMILESC/C1=C(\C)CCCCCCCCCCCCCCCCCCCC1
InChIInChI=1S/C24H46/c1-23-21-19-17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20-22-24(23)2/h3-22H2,1-2H3/b24-23-
InChIKeyJMVLTAYARLZJQP-VHXPQNKSSA-N
MW334.63 g/mol
LogP9.14
Rot. Bonds

About (1Z)-1,2-dimethylcyclodocosene

(1Z)-1,2-dimethylcyclodocosene (PubChem CID 134982656) has the molecular formula C24H46 and a molecular weight of 334.63 g/mol. Its IUPAC name is (1Z)-1,2-dimethylcyclodocosene.

Molecular Properties

Compound Name(1Z)-1,2-dimethylcyclodocosene
PubChem CID134982656
Molecular FormulaC24H46
Molecular Weight334.63 g/mol
Exact Mass334.36
IUPAC Name(1Z)-1,2-dimethylcyclodocosene
SMILESC/C1=C(\C)CCCCCCCCCCCCCCCCCCCC1
InChIInChI=1S/C24H46/c1-23-21-19-17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20-22-24(23)2/h3-22H2,1-2H3/b24-23-
InChIKeyJMVLTAYARLZJQP-VHXPQNKSSA-N
XLogP9.14
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500334.63
LogP ≤ 59.14
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

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-dimethylcyclodocosene?
The IUPAC name of (1Z)-1,2-dimethylcyclodocosene (CID 134982656) is (1Z)-1,2-dimethylcyclodocosene.
What is the SMILES notation for (1Z)-1,2-dimethylcyclodocosene?
The canonical SMILES for (1Z)-1,2-dimethylcyclodocosene is C/C1=C(\C)CCCCCCCCCCCCCCCCCCCC1.
What is the InChIKey of (1Z)-1,2-dimethylcyclodocosene?
The InChIKey is JMVLTAYARLZJQP-VHXPQNKSSA-N. The full InChI is InChI=1S/C24H46/c1-23-21-19-17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20-22-24(23)2/h3-22H2,1-2H3/b24-23-.
What are the key properties of (1Z)-1,2-dimethylcyclodocosene?
(1Z)-1,2-dimethylcyclodocosene has a molecular weight of 334.63 g/mol, XLogP of 9.14, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z)-1,2-dimethylcyclodocosene is sourced from PubChem (CID 134982656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).