1-methyl-6-methylidenecyclohexene

C8H12 — CID 13048025

IUPAC1-methyl-6-methylidenecyclohexene
SMILESC=C1CCCC=C1C
InChIInChI=1S/C8H12/c1-7-5-3-4-6-8(7)2/h6H,1,3-5H2,2H3
InChIKeyGEKFWEFHLOEKFR-UHFFFAOYSA-N
MW108.18 g/mol
LogP2.67
Rot. Bonds

About 1-methyl-6-methylidenecyclohexene

1-methyl-6-methylidenecyclohexene (PubChem CID 13048025) has the molecular formula C8H12 and a molecular weight of 108.18 g/mol. Its IUPAC name is 1-methyl-6-methylidenecyclohexene.

Molecular Properties

Compound Name1-methyl-6-methylidenecyclohexene
PubChem CID13048025
Molecular FormulaC8H12
Molecular Weight108.18 g/mol
Exact Mass108.09
IUPAC Name1-methyl-6-methylidenecyclohexene
SMILESC=C1CCCC=C1C
InChIInChI=1S/C8H12/c1-7-5-3-4-6-8(7)2/h6H,1,3-5H2,2H3
InChIKeyGEKFWEFHLOEKFR-UHFFFAOYSA-N
XLogP2.67
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500108.18
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-6-methylidenecyclohexene?
The IUPAC name of 1-methyl-6-methylidenecyclohexene (CID 13048025) is 1-methyl-6-methylidenecyclohexene.
What is the SMILES notation for 1-methyl-6-methylidenecyclohexene?
The canonical SMILES for 1-methyl-6-methylidenecyclohexene is C=C1CCCC=C1C.
What is the InChIKey of 1-methyl-6-methylidenecyclohexene?
The InChIKey is GEKFWEFHLOEKFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12/c1-7-5-3-4-6-8(7)2/h6H,1,3-5H2,2H3.
What are the key properties of 1-methyl-6-methylidenecyclohexene?
1-methyl-6-methylidenecyclohexene has a molecular weight of 108.18 g/mol, XLogP of 2.67, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-6-methylidenecyclohexene is sourced from PubChem (CID 13048025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).