8-(3,5-dimethylcyclohexyl)spiro[4.5]decan-8-ol

C18H32O — CID 114819192

IUPAC8-(3,5-dimethylcyclohexyl)spiro[4.5]decan-8-ol
SMILESCC1CC(C)CC(C2(O)CCC3(CCCC3)CC2)C1
InChIInChI=1S/C18H32O/c1-14-11-15(2)13-16(12-14)18(19)9-7-17(8-10-18)5-3-4-6-17/h14-16,19H,3-13H2,1-2H3
InChIKeyMSUIGHBXCHWPCO-UHFFFAOYSA-N
MW264.45 g/mol
LogP4.92
Rot. Bonds1

About 8-(3,5-dimethylcyclohexyl)spiro[4.5]decan-8-ol

8-(3,5-dimethylcyclohexyl)spiro[4.5]decan-8-ol (PubChem CID 114819192) has the molecular formula C18H32O and a molecular weight of 264.45 g/mol. Its IUPAC name is 8-(3,5-dimethylcyclohexyl)spiro[4.5]decan-8-ol.

Molecular Properties

Compound Name8-(3,5-dimethylcyclohexyl)spiro[4.5]decan-8-ol
PubChem CID114819192
Molecular FormulaC18H32O
Molecular Weight264.45 g/mol
Exact Mass264.25
IUPAC Name8-(3,5-dimethylcyclohexyl)spiro[4.5]decan-8-ol
SMILESCC1CC(C)CC(C2(O)CCC3(CCCC3)CC2)C1
InChIInChI=1S/C18H32O/c1-14-11-15(2)13-16(12-14)18(19)9-7-17(8-10-18)5-3-4-6-17/h14-16,19H,3-13H2,1-2H3
InChIKeyMSUIGHBXCHWPCO-UHFFFAOYSA-N
XLogP4.92
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.45
LogP ≤ 54.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 8-(3,5-dimethylcyclohexyl)spiro[4.5]decan-8-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 8-(3,5-dimethylcyclohexyl)spiro[4.5]decan-8-ol?
The IUPAC name of 8-(3,5-dimethylcyclohexyl)spiro[4.5]decan-8-ol (CID 114819192) is 8-(3,5-dimethylcyclohexyl)spiro[4.5]decan-8-ol.
What is the SMILES notation for 8-(3,5-dimethylcyclohexyl)spiro[4.5]decan-8-ol?
The canonical SMILES for 8-(3,5-dimethylcyclohexyl)spiro[4.5]decan-8-ol is CC1CC(C)CC(C2(O)CCC3(CCCC3)CC2)C1.
What is the InChIKey of 8-(3,5-dimethylcyclohexyl)spiro[4.5]decan-8-ol?
The InChIKey is MSUIGHBXCHWPCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32O/c1-14-11-15(2)13-16(12-14)18(19)9-7-17(8-10-18)5-3-4-6-17/h14-16,19H,3-13H2,1-2H3.
What are the key properties of 8-(3,5-dimethylcyclohexyl)spiro[4.5]decan-8-ol?
8-(3,5-dimethylcyclohexyl)spiro[4.5]decan-8-ol has a molecular weight of 264.45 g/mol, XLogP of 4.92, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(3,5-dimethylcyclohexyl)spiro[4.5]decan-8-ol is sourced from PubChem (CID 114819192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).