1-(4-methylphenyl)-2-phenylpentan-2-ol

C18H22O — CID 60797697

IUPAC1-(4-methylphenyl)-2-phenylpentan-2-ol
SMILESCCCC(O)(Cc1ccc(C)cc1)c1ccccc1
InChIInChI=1S/C18H22O/c1-3-13-18(19,17-7-5-4-6-8-17)14-16-11-9-15(2)10-12-16/h4-12,19H,3,13-14H2,1-2H3
InChIKeyJMNJLFQCHQXLBD-UHFFFAOYSA-N
MW254.37 g/mol
LogP4.23
Rot. Bonds5

About 1-(4-methylphenyl)-2-phenylpentan-2-ol

1-(4-methylphenyl)-2-phenylpentan-2-ol (PubChem CID 60797697) has the molecular formula C18H22O and a molecular weight of 254.37 g/mol. Its IUPAC name is 1-(4-methylphenyl)-2-phenylpentan-2-ol.

Molecular Properties

Compound Name1-(4-methylphenyl)-2-phenylpentan-2-ol
PubChem CID60797697
Molecular FormulaC18H22O
Molecular Weight254.37 g/mol
Exact Mass254.17
IUPAC Name1-(4-methylphenyl)-2-phenylpentan-2-ol
SMILESCCCC(O)(Cc1ccc(C)cc1)c1ccccc1
InChIInChI=1S/C18H22O/c1-3-13-18(19,17-7-5-4-6-8-17)14-16-11-9-15(2)10-12-16/h4-12,19H,3,13-14H2,1-2H3
InChIKeyJMNJLFQCHQXLBD-UHFFFAOYSA-N
XLogP4.23
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(4-bromophenyl)-2-phenylpentan-2-ol
CID 60797698
1,2-diphenylheptan-2-ol
CID 139785734
1-(3-fluoro-4-methoxyphenyl)-2-phenylpentan-2-ol
CID 65146578
1-(1-methylpyrazol-4-yl)-2-phenylpentan-2-ol
CID 62127136
(2S)-1-(4-chlorophenyl)-2-phenylbutan-2-ol
CID 93325474
1-methoxy-2-phenylpentan-2-ol
CID 79566426
3-[(4-methylphenyl)methyl]pentan-3-ol
CID 60799364
1-phenylpentane-2,2-diol
CID 56635388
1-(2-chloro-3-fluorophenyl)-2-phenylpentan-2-ol
CID 115983354
4-(2-hydroxy-1-phenylundecan-2-yl)phenol
CID 175286085
1-azido-2-phenylpentan-2-ol
CID 141488239
1-chloro-1-(4-methylphenyl)-2-phenylethanol
CID 139664712

Frequently Asked Questions

What is the IUPAC name of 1-(4-methylphenyl)-2-phenylpentan-2-ol?
The IUPAC name of 1-(4-methylphenyl)-2-phenylpentan-2-ol (CID 60797697) is 1-(4-methylphenyl)-2-phenylpentan-2-ol.
What is the SMILES notation for 1-(4-methylphenyl)-2-phenylpentan-2-ol?
The canonical SMILES for 1-(4-methylphenyl)-2-phenylpentan-2-ol is CCCC(O)(Cc1ccc(C)cc1)c1ccccc1.
What is the InChIKey of 1-(4-methylphenyl)-2-phenylpentan-2-ol?
The InChIKey is JMNJLFQCHQXLBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22O/c1-3-13-18(19,17-7-5-4-6-8-17)14-16-11-9-15(2)10-12-16/h4-12,19H,3,13-14H2,1-2H3.
What are the key properties of 1-(4-methylphenyl)-2-phenylpentan-2-ol?
1-(4-methylphenyl)-2-phenylpentan-2-ol has a molecular weight of 254.37 g/mol, XLogP of 4.23, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylphenyl)-2-phenylpentan-2-ol is sourced from PubChem (CID 60797697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).