1-(4-methyl-3-phenylphenyl)propan-2-ol

C16H18O — CID 117325758

IUPAC1-(4-methyl-3-phenylphenyl)propan-2-ol
SMILESCc1ccc(CC(C)O)cc1-c1ccccc1
InChIInChI=1S/C16H18O/c1-12-8-9-14(10-13(2)17)11-16(12)15-6-4-3-5-7-15/h3-9,11,13,17H,10H2,1-2H3
InChIKeyGYPGESQDYJSVKN-UHFFFAOYSA-N
MW226.32 g/mol
LogP3.59
Rot. Bonds3

About 1-(4-methyl-3-phenylphenyl)propan-2-ol

1-(4-methyl-3-phenylphenyl)propan-2-ol (PubChem CID 117325758) has the molecular formula C16H18O and a molecular weight of 226.32 g/mol. Its IUPAC name is 1-(4-methyl-3-phenylphenyl)propan-2-ol.

Molecular Properties

Compound Name1-(4-methyl-3-phenylphenyl)propan-2-ol
PubChem CID117325758
Molecular FormulaC16H18O
Molecular Weight226.32 g/mol
Exact Mass226.14
IUPAC Name1-(4-methyl-3-phenylphenyl)propan-2-ol
SMILESCc1ccc(CC(C)O)cc1-c1ccccc1
InChIInChI=1S/C16H18O/c1-12-8-9-14(10-13(2)17)11-16(12)15-6-4-3-5-7-15/h3-9,11,13,17H,10H2,1-2H3
InChIKeyGYPGESQDYJSVKN-UHFFFAOYSA-N
XLogP3.59
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2R)-1-(4-phenylphenyl)propan-2-ol
CID 92983269
3-(4-methyl-3-phenylphenyl)propan-1-ol
CID 117325760
[4-methyl-3-(4-phenylphenyl)phenyl]methanamine
CID 105408962
1-[(4-methyl-3-phenylphenyl)methyl]cyclopropan-1-ol
CID 117349615
2-(4-methyl-3-phenylphenyl)propanoic acid
CID 117353578
sodium;hydride;1-phenylpropan-2-ol
CID 175039142
3-(4-fluoro-3-phenylphenyl)-2-methylpropanoic acid
CID 117399352
2-methyl-1-(4-methyl-3-phenylphenyl)propan-1-one
CID 82117119
1-methyl-4-phenyl-2-(4-propylphenyl)benzene
CID 123627409
1-(4-methyl-3-phenylphenyl)prop-2-en-1-ol
CID 139935351
1-methyl-4-(2-methyl-3-phenylpropyl)-2-propan-2-ylbenzene
CID 142148485
1-methyl-4-(4-methylphenyl)-2-phenylbenzene
CID 18683184

Frequently Asked Questions

What is the IUPAC name of 1-(4-methyl-3-phenylphenyl)propan-2-ol?
The IUPAC name of 1-(4-methyl-3-phenylphenyl)propan-2-ol (CID 117325758) is 1-(4-methyl-3-phenylphenyl)propan-2-ol.
What is the SMILES notation for 1-(4-methyl-3-phenylphenyl)propan-2-ol?
The canonical SMILES for 1-(4-methyl-3-phenylphenyl)propan-2-ol is Cc1ccc(CC(C)O)cc1-c1ccccc1.
What is the InChIKey of 1-(4-methyl-3-phenylphenyl)propan-2-ol?
The InChIKey is GYPGESQDYJSVKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18O/c1-12-8-9-14(10-13(2)17)11-16(12)15-6-4-3-5-7-15/h3-9,11,13,17H,10H2,1-2H3.
What are the key properties of 1-(4-methyl-3-phenylphenyl)propan-2-ol?
1-(4-methyl-3-phenylphenyl)propan-2-ol has a molecular weight of 226.32 g/mol, XLogP of 3.59, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methyl-3-phenylphenyl)propan-2-ol is sourced from PubChem (CID 117325758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).