(E,2S,3R)-2,3,5-triphenylpent-4-en-2-ol

C23H22O — CID 10615189

IUPAC(E,2S,3R)-2,3,5-triphenylpent-4-en-2-ol
SMILESC[C@@](O)(c1ccccc1)[C@H](/C=C/c1ccccc1)c1ccccc1
InChIInChI=1S/C23H22O/c1-23(24,21-15-9-4-10-16-21)22(20-13-7-3-8-14-20)18-17-19-11-5-2-6-12-19/h2-18,22,24H,1H3/b18-17+/t22-,23-/m1/s1
InChIKeyWOBHUTYNDFIARM-GERLKTCDSA-N
MW314.43 g/mol
LogP5.39
Rot. Bonds5

About (E,2S,3R)-2,3,5-triphenylpent-4-en-2-ol

(E,2S,3R)-2,3,5-triphenylpent-4-en-2-ol (PubChem CID 10615189) has the molecular formula C23H22O and a molecular weight of 314.43 g/mol. Its IUPAC name is (E,2S,3R)-2,3,5-triphenylpent-4-en-2-ol.

Molecular Properties

Compound Name(E,2S,3R)-2,3,5-triphenylpent-4-en-2-ol
PubChem CID10615189
Molecular FormulaC23H22O
Molecular Weight314.43 g/mol
Exact Mass314.17
IUPAC Name(E,2S,3R)-2,3,5-triphenylpent-4-en-2-ol
SMILESC[C@@](O)(c1ccccc1)[C@H](/C=C/c1ccccc1)c1ccccc1
InChIInChI=1S/C23H22O/c1-23(24,21-15-9-4-10-16-21)22(20-13-7-3-8-14-20)18-17-19-11-5-2-6-12-19/h2-18,22,24H,1H3/b18-17+/t22-,23-/m1/s1
InChIKeyWOBHUTYNDFIARM-GERLKTCDSA-N
XLogP5.39
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500314.43
LogP ≤ 55.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(E,2R,3R)-2-methyl-2,3,5-triphenylpent-4-enal
CID 100913808
(2S,3S)-2,3-diphenylpent-4-en-2-ol
CID 11651629
(E,2R,3R)-2-phenylhex-4-ene-2,3-diol
CID 102188552
(E,2S,3S)-3-methyl-2-phenylhex-4-en-2-ol
CID 10583846
tert-butyl-[(Z,1S)-1,3-diphenylprop-2-enyl]-dimethylsilane
CID 102432622
(Z,2R)-4-phenylbut-3-en-2-ol
CID 11457765
[(E)-1,3-diphenylprop-2-enyl] 4-tert-butylbenzoate
CID 101260855
3-phenylprop-2-ene-1,1-diol
CID 54432533
trimethyl(2-phenylethenyl)phosphanium
CID 69015838
(Z)-1,1,3-triphenylprop-2-en-1-ol
CID 92856099
(E,2S)-1,1,1-tribromo-4-phenylbut-3-en-2-ol
CID 129409004
tert-butyl N-[(E,1R,2S)-1-hydroxy-1,4-diphenylbut-3-en-2-yl]carbamate
CID 122224320

Frequently Asked Questions

What is the IUPAC name of (E,2S,3R)-2,3,5-triphenylpent-4-en-2-ol?
The IUPAC name of (E,2S,3R)-2,3,5-triphenylpent-4-en-2-ol (CID 10615189) is (E,2S,3R)-2,3,5-triphenylpent-4-en-2-ol.
What is the SMILES notation for (E,2S,3R)-2,3,5-triphenylpent-4-en-2-ol?
The canonical SMILES for (E,2S,3R)-2,3,5-triphenylpent-4-en-2-ol is C[C@@](O)(c1ccccc1)[C@H](/C=C/c1ccccc1)c1ccccc1.
What is the InChIKey of (E,2S,3R)-2,3,5-triphenylpent-4-en-2-ol?
The InChIKey is WOBHUTYNDFIARM-GERLKTCDSA-N. The full InChI is InChI=1S/C23H22O/c1-23(24,21-15-9-4-10-16-21)22(20-13-7-3-8-14-20)18-17-19-11-5-2-6-12-19/h2-18,22,24H,1H3/b18-17+/t22-,23-/m1/s1.
What are the key properties of (E,2S,3R)-2,3,5-triphenylpent-4-en-2-ol?
(E,2S,3R)-2,3,5-triphenylpent-4-en-2-ol has a molecular weight of 314.43 g/mol, XLogP of 5.39, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E,2S,3R)-2,3,5-triphenylpent-4-en-2-ol is sourced from PubChem (CID 10615189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).