3-cyclopropyl-1-(naphthalen-1-ylmethyl)cyclohexan-1-ol

C20H24O — CID 65154003

IUPAC3-cyclopropyl-1-(naphthalen-1-ylmethyl)cyclohexan-1-ol
SMILESOC1(Cc2cccc3ccccc23)CCCC(C2CC2)C1
InChIInChI=1S/C20H24O/c21-20(12-4-8-17(13-20)15-10-11-15)14-18-7-3-6-16-5-1-2-9-19(16)18/h1-3,5-7,9,15,17,21H,4,8,10-14H2
InChIKeyDDLIRJXCCQZMGY-UHFFFAOYSA-N
MW280.41 g/mol
LogP4.71
Rot. Bonds3

About 3-cyclopropyl-1-(naphthalen-1-ylmethyl)cyclohexan-1-ol

3-cyclopropyl-1-(naphthalen-1-ylmethyl)cyclohexan-1-ol (PubChem CID 65154003) has the molecular formula C20H24O and a molecular weight of 280.41 g/mol. Its IUPAC name is 3-cyclopropyl-1-(naphthalen-1-ylmethyl)cyclohexan-1-ol.

Molecular Properties

Compound Name3-cyclopropyl-1-(naphthalen-1-ylmethyl)cyclohexan-1-ol
PubChem CID65154003
Molecular FormulaC20H24O
Molecular Weight280.41 g/mol
Exact Mass280.18
IUPAC Name3-cyclopropyl-1-(naphthalen-1-ylmethyl)cyclohexan-1-ol
SMILESOC1(Cc2cccc3ccccc23)CCCC(C2CC2)C1
InChIInChI=1S/C20H24O/c21-20(12-4-8-17(13-20)15-10-11-15)14-18-7-3-6-16-5-1-2-9-19(16)18/h1-3,5-7,9,15,17,21H,4,8,10-14H2
InChIKeyDDLIRJXCCQZMGY-UHFFFAOYSA-N
XLogP4.71
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.41
LogP ≤ 54.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 3-cyclopropyl-1-(naphthalen-1-ylmethyl)cyclohexan-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-cyclopropyl-1-(naphthalen-1-ylmethyl)cyclohexan-1-ol?
The IUPAC name of 3-cyclopropyl-1-(naphthalen-1-ylmethyl)cyclohexan-1-ol (CID 65154003) is 3-cyclopropyl-1-(naphthalen-1-ylmethyl)cyclohexan-1-ol.
What is the SMILES notation for 3-cyclopropyl-1-(naphthalen-1-ylmethyl)cyclohexan-1-ol?
The canonical SMILES for 3-cyclopropyl-1-(naphthalen-1-ylmethyl)cyclohexan-1-ol is OC1(Cc2cccc3ccccc23)CCCC(C2CC2)C1.
What is the InChIKey of 3-cyclopropyl-1-(naphthalen-1-ylmethyl)cyclohexan-1-ol?
The InChIKey is DDLIRJXCCQZMGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24O/c21-20(12-4-8-17(13-20)15-10-11-15)14-18-7-3-6-16-5-1-2-9-19(16)18/h1-3,5-7,9,15,17,21H,4,8,10-14H2.
What are the key properties of 3-cyclopropyl-1-(naphthalen-1-ylmethyl)cyclohexan-1-ol?
3-cyclopropyl-1-(naphthalen-1-ylmethyl)cyclohexan-1-ol has a molecular weight of 280.41 g/mol, XLogP of 4.71, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-1-(naphthalen-1-ylmethyl)cyclohexan-1-ol is sourced from PubChem (CID 65154003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).