1,6-dimethyl-3-methylidenecycloheptene

C10H16 — CID 165016233

IUPAC1,6-dimethyl-3-methylidenecycloheptene
SMILESC=C1C=C(C)CC(C)CC1
InChIInChI=1S/C10H16/c1-8-4-5-9(2)7-10(3)6-8/h6,9H,1,4-5,7H2,2-3H3
InChIKeyJIBMXZGDIFQYFY-UHFFFAOYSA-N
MW136.24 g/mol
LogP3.31
Rot. Bonds

About 1,6-dimethyl-3-methylidenecycloheptene

1,6-dimethyl-3-methylidenecycloheptene (PubChem CID 165016233) has the molecular formula C10H16 and a molecular weight of 136.24 g/mol. Its IUPAC name is 1,6-dimethyl-3-methylidenecycloheptene.

Molecular Properties

Compound Name1,6-dimethyl-3-methylidenecycloheptene
PubChem CID165016233
Molecular FormulaC10H16
Molecular Weight136.24 g/mol
Exact Mass136.13
IUPAC Name1,6-dimethyl-3-methylidenecycloheptene
SMILESC=C1C=C(C)CC(C)CC1
InChIInChI=1S/C10H16/c1-8-4-5-9(2)7-10(3)6-8/h6,9H,1,4-5,7H2,2-3H3
InChIKeyJIBMXZGDIFQYFY-UHFFFAOYSA-N
XLogP3.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.24
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1,6-dimethyl-3-methylidenecycloheptene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1,6-dimethyl-3-methylidenecycloheptene?
The IUPAC name of 1,6-dimethyl-3-methylidenecycloheptene (CID 165016233) is 1,6-dimethyl-3-methylidenecycloheptene.
What is the SMILES notation for 1,6-dimethyl-3-methylidenecycloheptene?
The canonical SMILES for 1,6-dimethyl-3-methylidenecycloheptene is C=C1C=C(C)CC(C)CC1.
What is the InChIKey of 1,6-dimethyl-3-methylidenecycloheptene?
The InChIKey is JIBMXZGDIFQYFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16/c1-8-4-5-9(2)7-10(3)6-8/h6,9H,1,4-5,7H2,2-3H3.
What are the key properties of 1,6-dimethyl-3-methylidenecycloheptene?
1,6-dimethyl-3-methylidenecycloheptene has a molecular weight of 136.24 g/mol, XLogP of 3.31, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,6-dimethyl-3-methylidenecycloheptene is sourced from PubChem (CID 165016233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).