1-(3,5-difluorophenyl)-2-(2-methylphenyl)propan-2-ol

C16H16F2O — CID 105402437

IUPAC1-(3,5-difluorophenyl)-2-(2-methylphenyl)propan-2-ol
SMILESCc1ccccc1C(C)(O)Cc1cc(F)cc(F)c1
InChIInChI=1S/C16H16F2O/c1-11-5-3-4-6-15(11)16(2,19)10-12-7-13(17)9-14(18)8-12/h3-9,19H,10H2,1-2H3
InChIKeyIXFVHGOWIOGOOT-UHFFFAOYSA-N
MW262.30 g/mol
LogP3.72
Rot. Bonds3

About 1-(3,5-difluorophenyl)-2-(2-methylphenyl)propan-2-ol

1-(3,5-difluorophenyl)-2-(2-methylphenyl)propan-2-ol (PubChem CID 105402437) has the molecular formula C16H16F2O and a molecular weight of 262.30 g/mol. Its IUPAC name is 1-(3,5-difluorophenyl)-2-(2-methylphenyl)propan-2-ol.

Molecular Properties

Compound Name1-(3,5-difluorophenyl)-2-(2-methylphenyl)propan-2-ol
PubChem CID105402437
Molecular FormulaC16H16F2O
Molecular Weight262.30 g/mol
Exact Mass262.12
IUPAC Name1-(3,5-difluorophenyl)-2-(2-methylphenyl)propan-2-ol
SMILESCc1ccccc1C(C)(O)Cc1cc(F)cc(F)c1
InChIInChI=1S/C16H16F2O/c1-11-5-3-4-6-15(11)16(2,19)10-12-7-13(17)9-14(18)8-12/h3-9,19H,10H2,1-2H3
InChIKeyIXFVHGOWIOGOOT-UHFFFAOYSA-N
XLogP3.72
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.30
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(3,5-difluorophenyl)-2-(2-fluorophenyl)propan-2-ol
CID 105402442
2-(2-bromophenyl)-1-(3,5-difluorophenyl)propan-2-ol
CID 105402450
1-(2,4-difluorophenyl)-2-(2-methylphenyl)propan-2-ol
CID 62198136
1-(3,5-difluorophenyl)-2-(4-methylphenyl)propan-2-ol
CID 105402436
1-(3-fluoro-4-methoxyphenyl)-2-(2-methylphenyl)propan-2-ol
CID 65144733
2-(5-fluoro-2-methylphenyl)-1-(3-fluorophenyl)propan-2-ol
CID 114833350
1-(3,5-difluorophenyl)-2-(3-fluorophenyl)propan-2-ol
CID 105402440
1-(4-methoxyphenyl)-2-(2-methylphenyl)propan-2-ol
CID 55169667
1-(3,5-difluorophenyl)-2-(2-fluorophenyl)propan-2-amine
CID 105402991
2-[2-methyl-4-(trifluoromethyl)phenyl]-1-phenylpropan-2-ol
CID 102751228
3-[1-(3,5-difluorophenyl)-2-hydroxypropan-2-yl]benzonitrile
CID 105402704
1-(2-chloro-4-fluorophenyl)-2-(2-chlorophenyl)propan-2-ol
CID 65145046

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-difluorophenyl)-2-(2-methylphenyl)propan-2-ol?
The IUPAC name of 1-(3,5-difluorophenyl)-2-(2-methylphenyl)propan-2-ol (CID 105402437) is 1-(3,5-difluorophenyl)-2-(2-methylphenyl)propan-2-ol.
What is the SMILES notation for 1-(3,5-difluorophenyl)-2-(2-methylphenyl)propan-2-ol?
The canonical SMILES for 1-(3,5-difluorophenyl)-2-(2-methylphenyl)propan-2-ol is Cc1ccccc1C(C)(O)Cc1cc(F)cc(F)c1.
What is the InChIKey of 1-(3,5-difluorophenyl)-2-(2-methylphenyl)propan-2-ol?
The InChIKey is IXFVHGOWIOGOOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16F2O/c1-11-5-3-4-6-15(11)16(2,19)10-12-7-13(17)9-14(18)8-12/h3-9,19H,10H2,1-2H3.
What are the key properties of 1-(3,5-difluorophenyl)-2-(2-methylphenyl)propan-2-ol?
1-(3,5-difluorophenyl)-2-(2-methylphenyl)propan-2-ol has a molecular weight of 262.30 g/mol, XLogP of 3.72, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-difluorophenyl)-2-(2-methylphenyl)propan-2-ol is sourced from PubChem (CID 105402437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).