(1R,4S,7R)-2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptan-7-ol

C10H16O — CID 10909763

IUPAC(1R,4S,7R)-2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptan-7-ol
SMILESC=C1[C@@H]2CC[C@@H]([C@H]2O)C1(C)C
InChIInChI=1S/C10H16O/c1-6-7-4-5-8(9(7)11)10(6,2)3/h7-9,11H,1,4-5H2,2-3H3/t7-,8-,9-/m0/s1
InChIKeyKWDIOXFYRVLXFK-CIUDSAMLSA-N
MW152.24 g/mol
LogP1.97
Rot. Bonds

About (1R,4S,7R)-2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptan-7-ol

(1R,4S,7R)-2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptan-7-ol (PubChem CID 10909763) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is (1R,4S,7R)-2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptan-7-ol.

Molecular Properties

Compound Name(1R,4S,7R)-2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptan-7-ol
PubChem CID10909763
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Name(1R,4S,7R)-2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptan-7-ol
SMILESC=C1[C@@H]2CC[C@@H]([C@H]2O)C1(C)C
InChIInChI=1S/C10H16O/c1-6-7-4-5-8(9(7)11)10(6,2)3/h7-9,11H,1,4-5H2,2-3H3/t7-,8-,9-/m0/s1
InChIKeyKWDIOXFYRVLXFK-CIUDSAMLSA-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 (1R,4S,7R)-2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptan-7-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 (1R,4S,7R)-2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptan-7-ol?
The IUPAC name of (1R,4S,7R)-2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptan-7-ol (CID 10909763) is (1R,4S,7R)-2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptan-7-ol.
What is the SMILES notation for (1R,4S,7R)-2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptan-7-ol?
The canonical SMILES for (1R,4S,7R)-2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptan-7-ol is C=C1[C@@H]2CC[C@@H]([C@H]2O)C1(C)C.
What is the InChIKey of (1R,4S,7R)-2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptan-7-ol?
The InChIKey is KWDIOXFYRVLXFK-CIUDSAMLSA-N. The full InChI is InChI=1S/C10H16O/c1-6-7-4-5-8(9(7)11)10(6,2)3/h7-9,11H,1,4-5H2,2-3H3/t7-,8-,9-/m0/s1.
What are the key properties of (1R,4S,7R)-2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptan-7-ol?
(1R,4S,7R)-2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptan-7-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 (1R,4S,7R)-2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptan-7-ol is sourced from PubChem (CID 10909763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).