(4-fluoro-3-methoxyphenyl)-[4-(2-methylpropyl)phenyl]methanol

C18H21FO2 — CID 81289069

IUPAC(4-fluoro-3-methoxyphenyl)-[4-(2-methylpropyl)phenyl]methanol
SMILESCOc1cc(C(O)c2ccc(CC(C)C)cc2)ccc1F
InChIInChI=1S/C18H21FO2/c1-12(2)10-13-4-6-14(7-5-13)18(20)15-8-9-16(19)17(11-15)21-3/h4-9,11-12,18,20H,10H2,1-3H3
InChIKeyVSOLWIGHEUPYRH-UHFFFAOYSA-N
MW288.36 g/mol
LogP4.11
Rot. Bonds5

About (4-fluoro-3-methoxyphenyl)-[4-(2-methylpropyl)phenyl]methanol

(4-fluoro-3-methoxyphenyl)-[4-(2-methylpropyl)phenyl]methanol (PubChem CID 81289069) has the molecular formula C18H21FO2 and a molecular weight of 288.36 g/mol. Its IUPAC name is (4-fluoro-3-methoxyphenyl)-[4-(2-methylpropyl)phenyl]methanol.

Molecular Properties

Compound Name(4-fluoro-3-methoxyphenyl)-[4-(2-methylpropyl)phenyl]methanol
PubChem CID81289069
Molecular FormulaC18H21FO2
Molecular Weight288.36 g/mol
Exact Mass288.15
IUPAC Name(4-fluoro-3-methoxyphenyl)-[4-(2-methylpropyl)phenyl]methanol
SMILESCOc1cc(C(O)c2ccc(CC(C)C)cc2)ccc1F
InChIInChI=1S/C18H21FO2/c1-12(2)10-13-4-6-14(7-5-13)18(20)15-8-9-16(19)17(11-15)21-3/h4-9,11-12,18,20H,10H2,1-3H3
InChIKeyVSOLWIGHEUPYRH-UHFFFAOYSA-N
XLogP4.11
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.36
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (4-fluoro-3-methoxyphenyl)-[4-(2-methylpropyl)phenyl]methanol 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

(4-fluoro-3-methoxyphenyl)-(4-methoxyphenyl)methanol
CID 81285020
(3-bromo-4-fluorophenyl)-(4-fluoro-3-methoxyphenyl)methanol
CID 81284804
(3,4-dichlorophenyl)-(4-fluoro-3-methoxyphenyl)methanol
CID 81284055
(4-fluoro-3-methoxyphenyl)-(3-methylphenyl)methanol
CID 114977925
[4-(2-methylpropyl)phenyl]-(2,4,6-trifluorophenyl)methanol
CID 65100834
4-[1-bromo-2-(4-methoxyphenyl)ethyl]-1-fluoro-2-methoxybenzene
CID 81284823
1-(4-fluoro-3-methoxyphenyl)-2-(4-methylphenyl)ethanamine
CID 81284853
4-[1-chloro-2-(4-methylphenyl)ethyl]-1-fluoro-2-methoxybenzene
CID 81284003
[4-[[1-(4-fluoro-3-methoxyphenyl)ethylamino]methyl]phenyl]methanol
CID 103947395
(3,4-dichlorophenyl)-[4-(2-methylpropyl)phenyl]methanol
CID 63428546
1-amino-3-(4-fluoro-3-methoxyphenyl)butan-2-ol
CID 83909820
(2,4-difluorophenyl)-[4-(2-methylpropyl)phenyl]methanol
CID 61100850

Frequently Asked Questions

What is the IUPAC name of (4-fluoro-3-methoxyphenyl)-[4-(2-methylpropyl)phenyl]methanol?
The IUPAC name of (4-fluoro-3-methoxyphenyl)-[4-(2-methylpropyl)phenyl]methanol (CID 81289069) is (4-fluoro-3-methoxyphenyl)-[4-(2-methylpropyl)phenyl]methanol.
What is the SMILES notation for (4-fluoro-3-methoxyphenyl)-[4-(2-methylpropyl)phenyl]methanol?
The canonical SMILES for (4-fluoro-3-methoxyphenyl)-[4-(2-methylpropyl)phenyl]methanol is COc1cc(C(O)c2ccc(CC(C)C)cc2)ccc1F.
What is the InChIKey of (4-fluoro-3-methoxyphenyl)-[4-(2-methylpropyl)phenyl]methanol?
The InChIKey is VSOLWIGHEUPYRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21FO2/c1-12(2)10-13-4-6-14(7-5-13)18(20)15-8-9-16(19)17(11-15)21-3/h4-9,11-12,18,20H,10H2,1-3H3.
What are the key properties of (4-fluoro-3-methoxyphenyl)-[4-(2-methylpropyl)phenyl]methanol?
(4-fluoro-3-methoxyphenyl)-[4-(2-methylpropyl)phenyl]methanol has a molecular weight of 288.36 g/mol, XLogP of 4.11, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluoro-3-methoxyphenyl)-[4-(2-methylpropyl)phenyl]methanol is sourced from PubChem (CID 81289069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).