7,7-dimethyl-4-methylidenebicyclo[4.1.0]heptan-3-ol

C10H16O — CID 534564

IUPAC7,7-dimethyl-4-methylidenebicyclo[4.1.0]heptan-3-ol
SMILESC=C1CC2C(CC1O)C2(C)C
InChIInChI=1S/C10H16O/c1-6-4-7-8(5-9(6)11)10(7,2)3/h7-9,11H,1,4-5H2,2-3H3
InChIKeyBKSIPWIAFSUQKX-UHFFFAOYSA-N
MW152.24 g/mol
LogP1.97
Rot. Bonds

About 7,7-dimethyl-4-methylidenebicyclo[4.1.0]heptan-3-ol

7,7-dimethyl-4-methylidenebicyclo[4.1.0]heptan-3-ol (PubChem CID 534564) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is 7,7-dimethyl-4-methylidenebicyclo[4.1.0]heptan-3-ol.

Molecular Properties

Compound Name7,7-dimethyl-4-methylidenebicyclo[4.1.0]heptan-3-ol
PubChem CID534564
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Name7,7-dimethyl-4-methylidenebicyclo[4.1.0]heptan-3-ol
SMILESC=C1CC2C(CC1O)C2(C)C
InChIInChI=1S/C10H16O/c1-6-4-7-8(5-9(6)11)10(7,2)3/h7-9,11H,1,4-5H2,2-3H3
InChIKeyBKSIPWIAFSUQKX-UHFFFAOYSA-N
XLogP1.97
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 7,7-dimethyl-4-methylidenebicyclo[4.1.0]heptan-3-ol 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 7,7-dimethyl-4-methylidenebicyclo[4.1.0]heptan-3-ol?
The IUPAC name of 7,7-dimethyl-4-methylidenebicyclo[4.1.0]heptan-3-ol (CID 534564) is 7,7-dimethyl-4-methylidenebicyclo[4.1.0]heptan-3-ol.
What is the SMILES notation for 7,7-dimethyl-4-methylidenebicyclo[4.1.0]heptan-3-ol?
The canonical SMILES for 7,7-dimethyl-4-methylidenebicyclo[4.1.0]heptan-3-ol is C=C1CC2C(CC1O)C2(C)C.
What is the InChIKey of 7,7-dimethyl-4-methylidenebicyclo[4.1.0]heptan-3-ol?
The InChIKey is BKSIPWIAFSUQKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O/c1-6-4-7-8(5-9(6)11)10(7,2)3/h7-9,11H,1,4-5H2,2-3H3.
What are the key properties of 7,7-dimethyl-4-methylidenebicyclo[4.1.0]heptan-3-ol?
7,7-dimethyl-4-methylidenebicyclo[4.1.0]heptan-3-ol has a molecular weight of 152.24 g/mol, XLogP of 1.97, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7,7-dimethyl-4-methylidenebicyclo[4.1.0]heptan-3-ol is sourced from PubChem (CID 534564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).