1-(4-methylphenyl)-5-phenylpentan-2-ol

C18H22O — CID 62606393

IUPAC1-(4-methylphenyl)-5-phenylpentan-2-ol
SMILESCc1ccc(CC(O)CCCc2ccccc2)cc1
InChIInChI=1S/C18H22O/c1-15-10-12-17(13-11-15)14-18(19)9-5-8-16-6-3-2-4-7-16/h2-4,6-7,10-13,18-19H,5,8-9,14H2,1H3
InChIKeyPGRUOAGTWNSDAV-UHFFFAOYSA-N
MW254.37 g/mol
LogP3.92
Rot. Bonds6

About 1-(4-methylphenyl)-5-phenylpentan-2-ol

1-(4-methylphenyl)-5-phenylpentan-2-ol (PubChem CID 62606393) has the molecular formula C18H22O and a molecular weight of 254.37 g/mol. Its IUPAC name is 1-(4-methylphenyl)-5-phenylpentan-2-ol.

Molecular Properties

Compound Name1-(4-methylphenyl)-5-phenylpentan-2-ol
PubChem CID62606393
Molecular FormulaC18H22O
Molecular Weight254.37 g/mol
Exact Mass254.17
IUPAC Name1-(4-methylphenyl)-5-phenylpentan-2-ol
SMILESCc1ccc(CC(O)CCCc2ccccc2)cc1
InChIInChI=1S/C18H22O/c1-15-10-12-17(13-11-15)14-18(19)9-5-8-16-6-3-2-4-7-16/h2-4,6-7,10-13,18-19H,5,8-9,14H2,1H3
InChIKeyPGRUOAGTWNSDAV-UHFFFAOYSA-N
XLogP3.92
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1,4-bis(4-methylphenyl)butan-2-ol
CID 63016226
1-(2-chloro-4-methylphenyl)-5-phenylpentan-2-ol
CID 106868054
1-(4-methylphenyl)octan-2-ol
CID 62607878
1,6-diphenylhexane-2,5-diol
CID 15072586
(2R)-5-phenylpentane-1,2-diol
CID 102483629
(2R)-1-(4-methylphenyl)butan-2-ol
CID 39235998
(2S)-1-(4-methylphenyl)butan-2-ol
CID 39236000
4-(3-methylphenyl)-1-phenylbutan-2-ol
CID 63016612
1-(3-methyl-2-pyridinyl)-5-phenylpentan-2-ol
CID 66459697
4-(4-methylphenyl)-1-phenylbutan-2-amine
CID 55084075
1-(dimethylamino)-5-phenylpentan-2-ol
CID 79087865
1-(2-methoxyphenyl)-5-phenylpentan-2-ol
CID 62606153

Frequently Asked Questions

What is the IUPAC name of 1-(4-methylphenyl)-5-phenylpentan-2-ol?
The IUPAC name of 1-(4-methylphenyl)-5-phenylpentan-2-ol (CID 62606393) is 1-(4-methylphenyl)-5-phenylpentan-2-ol.
What is the SMILES notation for 1-(4-methylphenyl)-5-phenylpentan-2-ol?
The canonical SMILES for 1-(4-methylphenyl)-5-phenylpentan-2-ol is Cc1ccc(CC(O)CCCc2ccccc2)cc1.
What is the InChIKey of 1-(4-methylphenyl)-5-phenylpentan-2-ol?
The InChIKey is PGRUOAGTWNSDAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22O/c1-15-10-12-17(13-11-15)14-18(19)9-5-8-16-6-3-2-4-7-16/h2-4,6-7,10-13,18-19H,5,8-9,14H2,1H3.
What are the key properties of 1-(4-methylphenyl)-5-phenylpentan-2-ol?
1-(4-methylphenyl)-5-phenylpentan-2-ol has a molecular weight of 254.37 g/mol, XLogP of 3.92, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylphenyl)-5-phenylpentan-2-ol is sourced from PubChem (CID 62606393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).