cyclopropylidene-[4-(4-ethylcyclohexyl)cyclohexyl]methanol

C18H30O — CID 71170220

IUPACcyclopropylidene-[4-(4-ethylcyclohexyl)cyclohexyl]methanol
SMILESCCC1CCC(C2CCC(C(O)=C3CC3)CC2)CC1
InChIInChI=1S/C18H30O/c1-2-13-3-5-14(6-4-13)15-7-9-16(10-8-15)18(19)17-11-12-17/h13-16,19H,2-12H2,1H3
InChIKeyJQZBQPRLWZDFLR-UHFFFAOYSA-N
MW262.44 g/mol
LogP5.62
Rot. Bonds3

About cyclopropylidene-[4-(4-ethylcyclohexyl)cyclohexyl]methanol

cyclopropylidene-[4-(4-ethylcyclohexyl)cyclohexyl]methanol (PubChem CID 71170220) has the molecular formula C18H30O and a molecular weight of 262.44 g/mol. Its IUPAC name is cyclopropylidene-[4-(4-ethylcyclohexyl)cyclohexyl]methanol.

Molecular Properties

Compound Namecyclopropylidene-[4-(4-ethylcyclohexyl)cyclohexyl]methanol
PubChem CID71170220
Molecular FormulaC18H30O
Molecular Weight262.44 g/mol
Exact Mass262.23
IUPAC Namecyclopropylidene-[4-(4-ethylcyclohexyl)cyclohexyl]methanol
SMILESCCC1CCC(C2CCC(C(O)=C3CC3)CC2)CC1
InChIInChI=1S/C18H30O/c1-2-13-3-5-14(6-4-13)15-7-9-16(10-8-15)18(19)17-11-12-17/h13-16,19H,2-12H2,1H3
InChIKeyJQZBQPRLWZDFLR-UHFFFAOYSA-N
XLogP5.62
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500262.44
LogP ≤ 55.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

Analyze cyclopropylidene-[4-(4-ethylcyclohexyl)cyclohexyl]methanol 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 cyclopropylidene-[4-(4-ethylcyclohexyl)cyclohexyl]methanol?
The IUPAC name of cyclopropylidene-[4-(4-ethylcyclohexyl)cyclohexyl]methanol (CID 71170220) is cyclopropylidene-[4-(4-ethylcyclohexyl)cyclohexyl]methanol.
What is the SMILES notation for cyclopropylidene-[4-(4-ethylcyclohexyl)cyclohexyl]methanol?
The canonical SMILES for cyclopropylidene-[4-(4-ethylcyclohexyl)cyclohexyl]methanol is CCC1CCC(C2CCC(C(O)=C3CC3)CC2)CC1.
What is the InChIKey of cyclopropylidene-[4-(4-ethylcyclohexyl)cyclohexyl]methanol?
The InChIKey is JQZBQPRLWZDFLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30O/c1-2-13-3-5-14(6-4-13)15-7-9-16(10-8-15)18(19)17-11-12-17/h13-16,19H,2-12H2,1H3.
What are the key properties of cyclopropylidene-[4-(4-ethylcyclohexyl)cyclohexyl]methanol?
cyclopropylidene-[4-(4-ethylcyclohexyl)cyclohexyl]methanol has a molecular weight of 262.44 g/mol, XLogP of 5.62, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropylidene-[4-(4-ethylcyclohexyl)cyclohexyl]methanol is sourced from PubChem (CID 71170220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).