1-(cyclopent-3-en-1-ylmethyl)-2-methylcyclooctane

C15H26 — CID 163738529

IUPAC1-(cyclopent-3-en-1-ylmethyl)-2-methylcyclooctane
SMILESCC1CCCCCCC1CC1CC=CC1
InChIInChI=1S/C15H26/c1-13-8-4-2-3-5-11-15(13)12-14-9-6-7-10-14/h6-7,13-15H,2-5,8-12H2,1H3
InChIKeyLFTMEOGYZWKWKS-UHFFFAOYSA-N
MW206.37 g/mol
LogP4.95
Rot. Bonds2

About 1-(cyclopent-3-en-1-ylmethyl)-2-methylcyclooctane

1-(cyclopent-3-en-1-ylmethyl)-2-methylcyclooctane (PubChem CID 163738529) has the molecular formula C15H26 and a molecular weight of 206.37 g/mol. Its IUPAC name is 1-(cyclopent-3-en-1-ylmethyl)-2-methylcyclooctane.

Molecular Properties

Compound Name1-(cyclopent-3-en-1-ylmethyl)-2-methylcyclooctane
PubChem CID163738529
Molecular FormulaC15H26
Molecular Weight206.37 g/mol
Exact Mass206.20
IUPAC Name1-(cyclopent-3-en-1-ylmethyl)-2-methylcyclooctane
SMILESCC1CCCCCCC1CC1CC=CC1
InChIInChI=1S/C15H26/c1-13-8-4-2-3-5-11-15(13)12-14-9-6-7-10-14/h6-7,13-15H,2-5,8-12H2,1H3
InChIKeyLFTMEOGYZWKWKS-UHFFFAOYSA-N
XLogP4.95
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.37
LogP ≤ 54.95
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-(cycloundecylmethyl)-2-methylcyclotridecane
CID 123643293
trans-(1S,2S)-1-(cyclopentylmethyl)-2-methylcyclopentane
CID 146946174
2-(cyclopent-3-en-1-ylmethyl)cycloheptan-1-amine
CID 164660864
1-methyl-2-[(2-methylcyclopentyl)methyl]cyclopentane
CID 148598305
(2-methylcyclodecyl)methanamine
CID 163635360
1,2,16-triethyl-15-methylcyclopentatriacontane
CID 123855410
2-(2-methylcyclopentyl)ethylcyclohexane
CID 134865391
cis-(1S,2S)-1-ethyl-2-methylcyclohexane
CID 23620237
3-methyl-4-[(2-methylcyclohexyl)methyl]-7,8-dioxatricyclo[4.1.1.01,6]octane
CID 87499761
2-[(2-methylcyclopentyl)methyl]azocane
CID 91042457
ethane;trans-(1S,2R)-1-ethyl-2-methylcyclohexane
CID 143479638
cis-(1S,2S)-1-(bromomethyl)-2-methylcyclohexane
CID 124509523

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopent-3-en-1-ylmethyl)-2-methylcyclooctane?
The IUPAC name of 1-(cyclopent-3-en-1-ylmethyl)-2-methylcyclooctane (CID 163738529) is 1-(cyclopent-3-en-1-ylmethyl)-2-methylcyclooctane.
What is the SMILES notation for 1-(cyclopent-3-en-1-ylmethyl)-2-methylcyclooctane?
The canonical SMILES for 1-(cyclopent-3-en-1-ylmethyl)-2-methylcyclooctane is CC1CCCCCCC1CC1CC=CC1.
What is the InChIKey of 1-(cyclopent-3-en-1-ylmethyl)-2-methylcyclooctane?
The InChIKey is LFTMEOGYZWKWKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26/c1-13-8-4-2-3-5-11-15(13)12-14-9-6-7-10-14/h6-7,13-15H,2-5,8-12H2,1H3.
What are the key properties of 1-(cyclopent-3-en-1-ylmethyl)-2-methylcyclooctane?
1-(cyclopent-3-en-1-ylmethyl)-2-methylcyclooctane has a molecular weight of 206.37 g/mol, XLogP of 4.95, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopent-3-en-1-ylmethyl)-2-methylcyclooctane is sourced from PubChem (CID 163738529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).