cyclopropyl-(4-fluorophenyl)-(4-methoxyphenyl)methanol

C17H17FO2 — CID 154301932

IUPACcyclopropyl-(4-fluorophenyl)-(4-methoxyphenyl)methanol
SMILESCOc1ccc(C(O)(c2ccc(F)cc2)C2CC2)cc1
InChIInChI=1S/C17H17FO2/c1-20-16-10-6-14(7-11-16)17(19,12-2-3-12)13-4-8-15(18)9-5-13/h4-12,19H,2-3H2,1H3
InChIKeyGHYGLJGTZQZVJE-UHFFFAOYSA-N
MW272.32 g/mol
LogP3.48
Rot. Bonds4

About cyclopropyl-(4-fluorophenyl)-(4-methoxyphenyl)methanol

cyclopropyl-(4-fluorophenyl)-(4-methoxyphenyl)methanol (PubChem CID 154301932) has the molecular formula C17H17FO2 and a molecular weight of 272.32 g/mol. Its IUPAC name is cyclopropyl-(4-fluorophenyl)-(4-methoxyphenyl)methanol.

Molecular Properties

Compound Namecyclopropyl-(4-fluorophenyl)-(4-methoxyphenyl)methanol
PubChem CID154301932
Molecular FormulaC17H17FO2
Molecular Weight272.32 g/mol
Exact Mass272.12
IUPAC Namecyclopropyl-(4-fluorophenyl)-(4-methoxyphenyl)methanol
SMILESCOc1ccc(C(O)(c2ccc(F)cc2)C2CC2)cc1
InChIInChI=1S/C17H17FO2/c1-20-16-10-6-14(7-11-16)17(19,12-2-3-12)13-4-8-15(18)9-5-13/h4-12,19H,2-3H2,1H3
InChIKeyGHYGLJGTZQZVJE-UHFFFAOYSA-N
XLogP3.48
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.32
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze cyclopropyl-(4-fluorophenyl)-(4-methoxyphenyl)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 cyclopropyl-(4-fluorophenyl)-(4-methoxyphenyl)methanol?
The IUPAC name of cyclopropyl-(4-fluorophenyl)-(4-methoxyphenyl)methanol (CID 154301932) is cyclopropyl-(4-fluorophenyl)-(4-methoxyphenyl)methanol.
What is the SMILES notation for cyclopropyl-(4-fluorophenyl)-(4-methoxyphenyl)methanol?
The canonical SMILES for cyclopropyl-(4-fluorophenyl)-(4-methoxyphenyl)methanol is COc1ccc(C(O)(c2ccc(F)cc2)C2CC2)cc1.
What is the InChIKey of cyclopropyl-(4-fluorophenyl)-(4-methoxyphenyl)methanol?
The InChIKey is GHYGLJGTZQZVJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FO2/c1-20-16-10-6-14(7-11-16)17(19,12-2-3-12)13-4-8-15(18)9-5-13/h4-12,19H,2-3H2,1H3.
What are the key properties of cyclopropyl-(4-fluorophenyl)-(4-methoxyphenyl)methanol?
cyclopropyl-(4-fluorophenyl)-(4-methoxyphenyl)methanol has a molecular weight of 272.32 g/mol, XLogP of 3.48, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-(4-fluorophenyl)-(4-methoxyphenyl)methanol is sourced from PubChem (CID 154301932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).