3-(2-bicyclo[2.2.1]heptanylmethyl)-3-methylcyclopentan-1-ol

C14H24O — CID 116540023

IUPAC3-(2-bicyclo[2.2.1]heptanylmethyl)-3-methylcyclopentan-1-ol
SMILESCC1(CC2CC3CCC2C3)CCC(O)C1
InChIInChI=1S/C14H24O/c1-14(5-4-13(15)9-14)8-12-7-10-2-3-11(12)6-10/h10-13,15H,2-9H2,1H3
InChIKeyCSDCXVNHMWELTO-UHFFFAOYSA-N
MW208.34 g/mol
LogP3.36
Rot. Bonds2

About 3-(2-bicyclo[2.2.1]heptanylmethyl)-3-methylcyclopentan-1-ol

3-(2-bicyclo[2.2.1]heptanylmethyl)-3-methylcyclopentan-1-ol (PubChem CID 116540023) has the molecular formula C14H24O and a molecular weight of 208.34 g/mol. Its IUPAC name is 3-(2-bicyclo[2.2.1]heptanylmethyl)-3-methylcyclopentan-1-ol.

Molecular Properties

Compound Name3-(2-bicyclo[2.2.1]heptanylmethyl)-3-methylcyclopentan-1-ol
PubChem CID116540023
Molecular FormulaC14H24O
Molecular Weight208.34 g/mol
Exact Mass208.18
IUPAC Name3-(2-bicyclo[2.2.1]heptanylmethyl)-3-methylcyclopentan-1-ol
SMILESCC1(CC2CC3CCC2C3)CCC(O)C1
InChIInChI=1S/C14H24O/c1-14(5-4-13(15)9-14)8-12-7-10-2-3-11(12)6-10/h10-13,15H,2-9H2,1H3
InChIKeyCSDCXVNHMWELTO-UHFFFAOYSA-N
XLogP3.36
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.34
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 3-(2-bicyclo[2.2.1]heptanylmethyl)-3-methylcyclopentan-1-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 3-(2-bicyclo[2.2.1]heptanylmethyl)-3-methylcyclopentan-1-ol?
The IUPAC name of 3-(2-bicyclo[2.2.1]heptanylmethyl)-3-methylcyclopentan-1-ol (CID 116540023) is 3-(2-bicyclo[2.2.1]heptanylmethyl)-3-methylcyclopentan-1-ol.
What is the SMILES notation for 3-(2-bicyclo[2.2.1]heptanylmethyl)-3-methylcyclopentan-1-ol?
The canonical SMILES for 3-(2-bicyclo[2.2.1]heptanylmethyl)-3-methylcyclopentan-1-ol is CC1(CC2CC3CCC2C3)CCC(O)C1.
What is the InChIKey of 3-(2-bicyclo[2.2.1]heptanylmethyl)-3-methylcyclopentan-1-ol?
The InChIKey is CSDCXVNHMWELTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O/c1-14(5-4-13(15)9-14)8-12-7-10-2-3-11(12)6-10/h10-13,15H,2-9H2,1H3.
What are the key properties of 3-(2-bicyclo[2.2.1]heptanylmethyl)-3-methylcyclopentan-1-ol?
3-(2-bicyclo[2.2.1]heptanylmethyl)-3-methylcyclopentan-1-ol has a molecular weight of 208.34 g/mol, XLogP of 3.36, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-bicyclo[2.2.1]heptanylmethyl)-3-methylcyclopentan-1-ol is sourced from PubChem (CID 116540023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).