(2S,3S)-2,3-diphenylpent-4-en-2-ol

C17H18O — CID 11651629

IUPAC(2S,3S)-2,3-diphenylpent-4-en-2-ol
SMILESC=C[C@@H](c1ccccc1)[C@](C)(O)c1ccccc1
InChIInChI=1S/C17H18O/c1-3-16(14-10-6-4-7-11-14)17(2,18)15-12-8-5-9-13-15/h3-13,16,18H,1H2,2H3/t16-,17+/m0/s1
InChIKeyOUYJXSCGDSQUTE-DLBZAZTESA-N
MW238.33 g/mol
LogP3.86
Rot. Bonds4

About (2S,3S)-2,3-diphenylpent-4-en-2-ol

(2S,3S)-2,3-diphenylpent-4-en-2-ol (PubChem CID 11651629) has the molecular formula C17H18O and a molecular weight of 238.33 g/mol. Its IUPAC name is (2S,3S)-2,3-diphenylpent-4-en-2-ol.

Molecular Properties

Compound Name(2S,3S)-2,3-diphenylpent-4-en-2-ol
PubChem CID11651629
Molecular FormulaC17H18O
Molecular Weight238.33 g/mol
Exact Mass238.14
IUPAC Name(2S,3S)-2,3-diphenylpent-4-en-2-ol
SMILESC=C[C@@H](c1ccccc1)[C@](C)(O)c1ccccc1
InChIInChI=1S/C17H18O/c1-3-16(14-10-6-4-7-11-14)17(2,18)15-12-8-5-9-13-15/h3-13,16,18H,1H2,2H3/t16-,17+/m0/s1
InChIKeyOUYJXSCGDSQUTE-DLBZAZTESA-N
XLogP3.86
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(3R,4R)-2,2,3-trimethyl-4-phenylhex-5-en-3-ol
CID 102279289
(E,2S,3R)-2,3,5-triphenylpent-4-en-2-ol
CID 10615189
(2S,3R)-2-cyclopropyl-3-phenylpent-4-en-2-ol
CID 122546090
(2R,3R)-2-hydroxy-1,2,3-triphenylpent-4-en-1-one
CID 134955660
2-hydroxy-1,2,3-triphenylpent-4-en-1-one
CID 11370873
1,1,1-trichlorobut-3-en-2-ylbenzene
CID 71393559
3-hydroxy-2-methyl-3-phenylbutanal
CID 140584728
N-(2,2-dimethyl-3,4-diphenylhex-5-en-3-yl)benzamide
CID 175544554
ethyl 2-hydroxy-2-methyl-3-phenylpent-4-enoate
CID 11107268
methyl (2R)-2-(1-hydroxy-1-phenylethyl)but-3-enoate
CID 134993343
[(3S,4S)-4-hydroxy-4-phenylpent-1-en-3-yl] acetate
CID 101235897
(1,1-difluoro-2-phenylbut-3-enyl)sulfanylbenzene
CID 102528016

Frequently Asked Questions

What is the IUPAC name of (2S,3S)-2,3-diphenylpent-4-en-2-ol?
The IUPAC name of (2S,3S)-2,3-diphenylpent-4-en-2-ol (CID 11651629) is (2S,3S)-2,3-diphenylpent-4-en-2-ol.
What is the SMILES notation for (2S,3S)-2,3-diphenylpent-4-en-2-ol?
The canonical SMILES for (2S,3S)-2,3-diphenylpent-4-en-2-ol is C=C[C@@H](c1ccccc1)[C@](C)(O)c1ccccc1.
What is the InChIKey of (2S,3S)-2,3-diphenylpent-4-en-2-ol?
The InChIKey is OUYJXSCGDSQUTE-DLBZAZTESA-N. The full InChI is InChI=1S/C17H18O/c1-3-16(14-10-6-4-7-11-14)17(2,18)15-12-8-5-9-13-15/h3-13,16,18H,1H2,2H3/t16-,17+/m0/s1.
What are the key properties of (2S,3S)-2,3-diphenylpent-4-en-2-ol?
(2S,3S)-2,3-diphenylpent-4-en-2-ol has a molecular weight of 238.33 g/mol, XLogP of 3.86, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,3S)-2,3-diphenylpent-4-en-2-ol is sourced from PubChem (CID 11651629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).