(E)-1-(2,5-dimethylphenyl)-5-phenylpent-1-en-3-ol

C19H22O — CID 155664993

IUPAC(E)-1-(2,5-dimethylphenyl)-5-phenylpent-1-en-3-ol
SMILESCc1ccc(C)c(/C=C/C(O)CCc2ccccc2)c1
InChIInChI=1S/C19H22O/c1-15-8-9-16(2)18(14-15)11-13-19(20)12-10-17-6-4-3-5-7-17/h3-9,11,13-14,19-20H,10,12H2,1-2H3/b13-11+
InChIKeyVPFJONXHVPGXKS-ACCUITESSA-N
MW266.38 g/mol
LogP4.31
Rot. Bonds5

About (E)-1-(2,5-dimethylphenyl)-5-phenylpent-1-en-3-ol

(E)-1-(2,5-dimethylphenyl)-5-phenylpent-1-en-3-ol (PubChem CID 155664993) has the molecular formula C19H22O and a molecular weight of 266.38 g/mol. Its IUPAC name is (E)-1-(2,5-dimethylphenyl)-5-phenylpent-1-en-3-ol.

Molecular Properties

Compound Name(E)-1-(2,5-dimethylphenyl)-5-phenylpent-1-en-3-ol
PubChem CID155664993
Molecular FormulaC19H22O
Molecular Weight266.38 g/mol
Exact Mass266.17
IUPAC Name(E)-1-(2,5-dimethylphenyl)-5-phenylpent-1-en-3-ol
SMILESCc1ccc(C)c(/C=C/C(O)CCc2ccccc2)c1
InChIInChI=1S/C19H22O/c1-15-8-9-16(2)18(14-15)11-13-19(20)12-10-17-6-4-3-5-7-17/h3-9,11,13-14,19-20H,10,12H2,1-2H3/b13-11+
InChIKeyVPFJONXHVPGXKS-ACCUITESSA-N
XLogP4.31
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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(E,3R)-1,5-diphenylhex-4-en-3-ol
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N-[(2,5-dimethylphenyl)methyl]-4-phenylbutan-2-amine
CID 60657519
2-[2-[4-[2-(2,5-dimethylphenyl)ethenyl]phenyl]ethenyl]-1,4-dimethylbenzene
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4-(3-methylphenyl)-1-phenylbutan-2-ol
CID 63016612
2,5-dimethyl-N-(4-phenylbutan-2-yl)aniline
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Frequently Asked Questions

What is the IUPAC name of (E)-1-(2,5-dimethylphenyl)-5-phenylpent-1-en-3-ol?
The IUPAC name of (E)-1-(2,5-dimethylphenyl)-5-phenylpent-1-en-3-ol (CID 155664993) is (E)-1-(2,5-dimethylphenyl)-5-phenylpent-1-en-3-ol.
What is the SMILES notation for (E)-1-(2,5-dimethylphenyl)-5-phenylpent-1-en-3-ol?
The canonical SMILES for (E)-1-(2,5-dimethylphenyl)-5-phenylpent-1-en-3-ol is Cc1ccc(C)c(/C=C/C(O)CCc2ccccc2)c1.
What is the InChIKey of (E)-1-(2,5-dimethylphenyl)-5-phenylpent-1-en-3-ol?
The InChIKey is VPFJONXHVPGXKS-ACCUITESSA-N. The full InChI is InChI=1S/C19H22O/c1-15-8-9-16(2)18(14-15)11-13-19(20)12-10-17-6-4-3-5-7-17/h3-9,11,13-14,19-20H,10,12H2,1-2H3/b13-11+.
What are the key properties of (E)-1-(2,5-dimethylphenyl)-5-phenylpent-1-en-3-ol?
(E)-1-(2,5-dimethylphenyl)-5-phenylpent-1-en-3-ol has a molecular weight of 266.38 g/mol, XLogP of 4.31, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-(2,5-dimethylphenyl)-5-phenylpent-1-en-3-ol is sourced from PubChem (CID 155664993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).