1-(3-fluoro-5-methylphenyl)-2-methyl-2-phenylpropan-1-ol

C17H19FO — CID 79703267

IUPAC1-(3-fluoro-5-methylphenyl)-2-methyl-2-phenylpropan-1-ol
SMILESCc1cc(F)cc(C(O)C(C)(C)c2ccccc2)c1
InChIInChI=1S/C17H19FO/c1-12-9-13(11-15(18)10-12)16(19)17(2,3)14-7-5-4-6-8-14/h4-11,16,19H,1-3H3
InChIKeyZHPRSQCHYXYMPQ-UHFFFAOYSA-N
MW258.34 g/mol
LogP4.15
Rot. Bonds3

About 1-(3-fluoro-5-methylphenyl)-2-methyl-2-phenylpropan-1-ol

1-(3-fluoro-5-methylphenyl)-2-methyl-2-phenylpropan-1-ol (PubChem CID 79703267) has the molecular formula C17H19FO and a molecular weight of 258.34 g/mol. Its IUPAC name is 1-(3-fluoro-5-methylphenyl)-2-methyl-2-phenylpropan-1-ol.

Molecular Properties

Compound Name1-(3-fluoro-5-methylphenyl)-2-methyl-2-phenylpropan-1-ol
PubChem CID79703267
Molecular FormulaC17H19FO
Molecular Weight258.34 g/mol
Exact Mass258.14
IUPAC Name1-(3-fluoro-5-methylphenyl)-2-methyl-2-phenylpropan-1-ol
SMILESCc1cc(F)cc(C(O)C(C)(C)c2ccccc2)c1
InChIInChI=1S/C17H19FO/c1-12-9-13(11-15(18)10-12)16(19)17(2,3)14-7-5-4-6-8-14/h4-11,16,19H,1-3H3
InChIKeyZHPRSQCHYXYMPQ-UHFFFAOYSA-N
XLogP4.15
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.34
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2-fluorophenyl)-2-methyl-2-phenylpropan-1-ol
CID 55180552
2-(3-chlorophenyl)-1-(3-fluorophenyl)-2-methylpropan-1-ol
CID 156883833
2-methyl-2-phenyl-1-(2,3,5,6-tetramethylphenyl)propan-1-ol
CID 63426066
1-(2,3-difluorophenyl)-2-methyl-2-phenylpropan-1-ol
CID 63989633
1-(3-fluoro-5-methylphenyl)-2-methoxy-2-phenylethanol
CID 116756883
1-(4-fluoro-2-methylphenyl)-3-methyl-3-phenylbutan-2-ol
CID 114347441
N-[(1S)-1-(3-fluoro-5-methylphenyl)ethyl]-N-methyl-1-phenylethanamine
CID 58819068
2-ethoxy-1-(3-fluoro-5-methylphenyl)-2-phenylethanol
CID 116757127
1-(2-ethoxy-5-methylphenyl)-2-methyl-2-phenylpropan-1-ol
CID 62301322
1,1,1-trifluoro-3-methyl-3-phenylbutan-2-ol
CID 66466095
tert-butylbenzene;1,3,5-trimethylbenzene
CID 173429948
1-(2,3-dichlorophenyl)-2-methyl-2-phenylpropan-1-ol
CID 63411078

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoro-5-methylphenyl)-2-methyl-2-phenylpropan-1-ol?
The IUPAC name of 1-(3-fluoro-5-methylphenyl)-2-methyl-2-phenylpropan-1-ol (CID 79703267) is 1-(3-fluoro-5-methylphenyl)-2-methyl-2-phenylpropan-1-ol.
What is the SMILES notation for 1-(3-fluoro-5-methylphenyl)-2-methyl-2-phenylpropan-1-ol?
The canonical SMILES for 1-(3-fluoro-5-methylphenyl)-2-methyl-2-phenylpropan-1-ol is Cc1cc(F)cc(C(O)C(C)(C)c2ccccc2)c1.
What is the InChIKey of 1-(3-fluoro-5-methylphenyl)-2-methyl-2-phenylpropan-1-ol?
The InChIKey is ZHPRSQCHYXYMPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FO/c1-12-9-13(11-15(18)10-12)16(19)17(2,3)14-7-5-4-6-8-14/h4-11,16,19H,1-3H3.
What are the key properties of 1-(3-fluoro-5-methylphenyl)-2-methyl-2-phenylpropan-1-ol?
1-(3-fluoro-5-methylphenyl)-2-methyl-2-phenylpropan-1-ol has a molecular weight of 258.34 g/mol, XLogP of 4.15, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluoro-5-methylphenyl)-2-methyl-2-phenylpropan-1-ol is sourced from PubChem (CID 79703267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).