3-(4-fluoro-2-methylphenyl)-2-(4-fluorophenyl)propan-1-ol

C16H16F2O — CID 114349840

IUPAC3-(4-fluoro-2-methylphenyl)-2-(4-fluorophenyl)propan-1-ol
SMILESCc1cc(F)ccc1CC(CO)c1ccc(F)cc1
InChIInChI=1S/C16H16F2O/c1-11-8-16(18)7-4-13(11)9-14(10-19)12-2-5-15(17)6-3-12/h2-8,14,19H,9-10H2,1H3
InChIKeyRQKCTNHIEWOPIW-UHFFFAOYSA-N
MW262.30 g/mol
LogP3.59
Rot. Bonds4

About 3-(4-fluoro-2-methylphenyl)-2-(4-fluorophenyl)propan-1-ol

3-(4-fluoro-2-methylphenyl)-2-(4-fluorophenyl)propan-1-ol (PubChem CID 114349840) has the molecular formula C16H16F2O and a molecular weight of 262.30 g/mol. Its IUPAC name is 3-(4-fluoro-2-methylphenyl)-2-(4-fluorophenyl)propan-1-ol.

Molecular Properties

Compound Name3-(4-fluoro-2-methylphenyl)-2-(4-fluorophenyl)propan-1-ol
PubChem CID114349840
Molecular FormulaC16H16F2O
Molecular Weight262.30 g/mol
Exact Mass262.12
IUPAC Name3-(4-fluoro-2-methylphenyl)-2-(4-fluorophenyl)propan-1-ol
SMILESCc1cc(F)ccc1CC(CO)c1ccc(F)cc1
InChIInChI=1S/C16H16F2O/c1-11-8-16(18)7-4-13(11)9-14(10-19)12-2-5-15(17)6-3-12/h2-8,14,19H,9-10H2,1H3
InChIKeyRQKCTNHIEWOPIW-UHFFFAOYSA-N
XLogP3.59
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.30
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 3-(4-fluoro-2-methylphenyl)-2-(4-fluorophenyl)propan-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

Related Compounds

2-(3-bromophenyl)-3-(4-fluoro-2-methylphenyl)propan-1-ol
CID 114349841
3-(4-bromo-2-fluorophenyl)-2-(4-fluorophenyl)propan-1-ol
CID 79438236
2-amino-3-(4-fluoro-2-methylphenyl)propan-1-ol
CID 115649532
3-(2,4-difluorophenyl)-2-phenylpropan-1-ol
CID 66059206
2-(4-chlorophenyl)-3-(4-fluoro-2-methylphenyl)propan-1-amine
CID 114348931
3-(5-fluoro-2-methylphenyl)-2-(3-fluorophenyl)propan-1-ol
CID 105375972
3-(2,4-difluorophenyl)-2-(3-methylphenyl)propan-1-ol
CID 79417400
3-(5-fluoro-2-methylphenyl)-2-(3-methylphenyl)propan-1-ol
CID 105375965
1-(4-fluoro-2-methylphenyl)propan-2-ol
CID 91636360
2-[(4-fluoro-2-methylphenyl)methyl]-4-methylpentan-1-ol
CID 114349814
3-(5-fluoro-2-methylphenyl)-2-(4-fluorophenyl)propan-1-amine
CID 105374999
2-(4-fluoro-2-methylphenyl)-1-(4-iodophenyl)ethanol
CID 115838318

Frequently Asked Questions

What is the IUPAC name of 3-(4-fluoro-2-methylphenyl)-2-(4-fluorophenyl)propan-1-ol?
The IUPAC name of 3-(4-fluoro-2-methylphenyl)-2-(4-fluorophenyl)propan-1-ol (CID 114349840) is 3-(4-fluoro-2-methylphenyl)-2-(4-fluorophenyl)propan-1-ol.
What is the SMILES notation for 3-(4-fluoro-2-methylphenyl)-2-(4-fluorophenyl)propan-1-ol?
The canonical SMILES for 3-(4-fluoro-2-methylphenyl)-2-(4-fluorophenyl)propan-1-ol is Cc1cc(F)ccc1CC(CO)c1ccc(F)cc1.
What is the InChIKey of 3-(4-fluoro-2-methylphenyl)-2-(4-fluorophenyl)propan-1-ol?
The InChIKey is RQKCTNHIEWOPIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16F2O/c1-11-8-16(18)7-4-13(11)9-14(10-19)12-2-5-15(17)6-3-12/h2-8,14,19H,9-10H2,1H3.
What are the key properties of 3-(4-fluoro-2-methylphenyl)-2-(4-fluorophenyl)propan-1-ol?
3-(4-fluoro-2-methylphenyl)-2-(4-fluorophenyl)propan-1-ol has a molecular weight of 262.30 g/mol, XLogP of 3.59, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluoro-2-methylphenyl)-2-(4-fluorophenyl)propan-1-ol is sourced from PubChem (CID 114349840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).