1-[1,2-di(cyclopenten-1-yl)-2,3,4-trimethylcyclopent-3-en-1-yl]cyclohexene

C24H34 — CID 141211419

IUPAC1-[1,2-di(cyclopenten-1-yl)-2,3,4-trimethylcyclopent-3-en-1-yl]cyclohexene
SMILESCC1=C(C)C(C)(C2=CCCC2)C(C2=CCCC2)(C2=CCCCC2)C1
InChIInChI=1S/C24H34/c1-18-17-24(22-15-9-10-16-22,21-13-5-4-6-14-21)23(3,19(18)2)20-11-7-8-12-20/h11,13,15H,4-10,12,14,16-17H2,1-3H3
InChIKeyFWROQCFNQQCZIP-UHFFFAOYSA-N
MW322.54 g/mol
LogP7.44
Rot. Bonds3

About 1-[1,2-di(cyclopenten-1-yl)-2,3,4-trimethylcyclopent-3-en-1-yl]cyclohexene

1-[1,2-di(cyclopenten-1-yl)-2,3,4-trimethylcyclopent-3-en-1-yl]cyclohexene (PubChem CID 141211419) has the molecular formula C24H34 and a molecular weight of 322.54 g/mol. Its IUPAC name is 1-[1,2-di(cyclopenten-1-yl)-2,3,4-trimethylcyclopent-3-en-1-yl]cyclohexene.

Molecular Properties

Compound Name1-[1,2-di(cyclopenten-1-yl)-2,3,4-trimethylcyclopent-3-en-1-yl]cyclohexene
PubChem CID141211419
Molecular FormulaC24H34
Molecular Weight322.54 g/mol
Exact Mass322.27
IUPAC Name1-[1,2-di(cyclopenten-1-yl)-2,3,4-trimethylcyclopent-3-en-1-yl]cyclohexene
SMILESCC1=C(C)C(C)(C2=CCCC2)C(C2=CCCC2)(C2=CCCCC2)C1
InChIInChI=1S/C24H34/c1-18-17-24(22-15-9-10-16-22,21-13-5-4-6-14-21)23(3,19(18)2)20-11-7-8-12-20/h11,13,15H,4-10,12,14,16-17H2,1-3H3
InChIKeyFWROQCFNQQCZIP-UHFFFAOYSA-N
XLogP7.44
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500322.54
LogP ≤ 57.44
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

1-(cyclohexen-1-yl)-4,4-dimethylcyclohexan-1-ol
CID 106651138
3-(cyclohexen-1-yl)-3-methyloxirane-2-carbonitrile
CID 85348686
1-(cyclohexen-1-yl)cyclohexan-1-amine
CID 56996461
1-methylcyclohexene;hydrofluoride
CID 157219805
(1R,5S)-6-(cyclohexen-1-yl)-6-methoxybicyclo[3.1.0]hexane
CID 101077777
1-(cyclohexen-1-yl)-2,4,4-trimethylcyclopentan-1-ol
CID 106663962
6-(cyclohexen-1-yl)-6-methylcyclohexa-2,4-diene-1-carboxylic acid
CID 135331838
(1E,7E)-2-methylbicyclo[6.2.1]undeca-1,7,9-triene
CID 163429403
6-(cyclohexen-1-yl)-1,6-di(cyclopenten-1-yl)cyclohexene
CID 141056447
11,11-dimethylbicyclo[5.3.1]undec-6-en-2-one
CID 24975296
3-(aminomethyl)-3-(cyclohexen-1-yl)cyclobutan-1-one
CID 116659378
(3S)-3-(cyclohexen-1-yl)-1,3-dimethylindol-2-one
CID 134964012

Frequently Asked Questions

What is the IUPAC name of 1-[1,2-di(cyclopenten-1-yl)-2,3,4-trimethylcyclopent-3-en-1-yl]cyclohexene?
The IUPAC name of 1-[1,2-di(cyclopenten-1-yl)-2,3,4-trimethylcyclopent-3-en-1-yl]cyclohexene (CID 141211419) is 1-[1,2-di(cyclopenten-1-yl)-2,3,4-trimethylcyclopent-3-en-1-yl]cyclohexene.
What is the SMILES notation for 1-[1,2-di(cyclopenten-1-yl)-2,3,4-trimethylcyclopent-3-en-1-yl]cyclohexene?
The canonical SMILES for 1-[1,2-di(cyclopenten-1-yl)-2,3,4-trimethylcyclopent-3-en-1-yl]cyclohexene is CC1=C(C)C(C)(C2=CCCC2)C(C2=CCCC2)(C2=CCCCC2)C1.
What is the InChIKey of 1-[1,2-di(cyclopenten-1-yl)-2,3,4-trimethylcyclopent-3-en-1-yl]cyclohexene?
The InChIKey is FWROQCFNQQCZIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H34/c1-18-17-24(22-15-9-10-16-22,21-13-5-4-6-14-21)23(3,19(18)2)20-11-7-8-12-20/h11,13,15H,4-10,12,14,16-17H2,1-3H3.
What are the key properties of 1-[1,2-di(cyclopenten-1-yl)-2,3,4-trimethylcyclopent-3-en-1-yl]cyclohexene?
1-[1,2-di(cyclopenten-1-yl)-2,3,4-trimethylcyclopent-3-en-1-yl]cyclohexene has a molecular weight of 322.54 g/mol, XLogP of 7.44, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1,2-di(cyclopenten-1-yl)-2,3,4-trimethylcyclopent-3-en-1-yl]cyclohexene is sourced from PubChem (CID 141211419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).