1-methyl-2-(1-methylcyclobutyl)cyclopentene

C11H18 — CID 57126334

IUPAC1-methyl-2-(1-methylcyclobutyl)cyclopentene
SMILESCC1=C(C2(C)CCC2)CCC1
InChIInChI=1S/C11H18/c1-9-5-3-6-10(9)11(2)7-4-8-11/h3-8H2,1-2H3
InChIKeyKSLGVEDQSSOPNH-UHFFFAOYSA-N
MW150.26 g/mol
LogP3.68
Rot. Bonds1

About 1-methyl-2-(1-methylcyclobutyl)cyclopentene

1-methyl-2-(1-methylcyclobutyl)cyclopentene (PubChem CID 57126334) has the molecular formula C11H18 and a molecular weight of 150.26 g/mol. Its IUPAC name is 1-methyl-2-(1-methylcyclobutyl)cyclopentene.

Molecular Properties

Compound Name1-methyl-2-(1-methylcyclobutyl)cyclopentene
PubChem CID57126334
Molecular FormulaC11H18
Molecular Weight150.26 g/mol
Exact Mass150.14
IUPAC Name1-methyl-2-(1-methylcyclobutyl)cyclopentene
SMILESCC1=C(C2(C)CCC2)CCC1
InChIInChI=1S/C11H18/c1-9-5-3-6-10(9)11(2)7-4-8-11/h3-8H2,1-2H3
InChIKeyKSLGVEDQSSOPNH-UHFFFAOYSA-N
XLogP3.68
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.26
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-(1-methylcyclobutyl)cyclopentene?
The IUPAC name of 1-methyl-2-(1-methylcyclobutyl)cyclopentene (CID 57126334) is 1-methyl-2-(1-methylcyclobutyl)cyclopentene.
What is the SMILES notation for 1-methyl-2-(1-methylcyclobutyl)cyclopentene?
The canonical SMILES for 1-methyl-2-(1-methylcyclobutyl)cyclopentene is CC1=C(C2(C)CCC2)CCC1.
What is the InChIKey of 1-methyl-2-(1-methylcyclobutyl)cyclopentene?
The InChIKey is KSLGVEDQSSOPNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18/c1-9-5-3-6-10(9)11(2)7-4-8-11/h3-8H2,1-2H3.
What are the key properties of 1-methyl-2-(1-methylcyclobutyl)cyclopentene?
1-methyl-2-(1-methylcyclobutyl)cyclopentene has a molecular weight of 150.26 g/mol, XLogP of 3.68, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-(1-methylcyclobutyl)cyclopentene is sourced from PubChem (CID 57126334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).