(2E,4E)-6-hydroxy-6-phenylhexa-2,4-dienamide

C12H13NO2 — CID 6449395

IUPAC(2E,4E)-6-hydroxy-6-phenylhexa-2,4-dienamide
SMILESNC(=O)/C=C/C=C/C(O)c1ccccc1
InChIInChI=1S/C12H13NO2/c13-12(15)9-5-4-8-11(14)10-6-2-1-3-7-10/h1-9,11,14H,(H2,13,15)/b8-4+,9-5+
InChIKeyURLWEJZUYQZEJB-KBXRYBNXSA-N
MW203.24 g/mol
LogP1.32
Rot. Bonds4

About (2E,4E)-6-hydroxy-6-phenylhexa-2,4-dienamide

(2E,4E)-6-hydroxy-6-phenylhexa-2,4-dienamide (PubChem CID 6449395) has the molecular formula C12H13NO2 and a molecular weight of 203.24 g/mol. Its IUPAC name is (2E,4E)-6-hydroxy-6-phenylhexa-2,4-dienamide.

Molecular Properties

Compound Name(2E,4E)-6-hydroxy-6-phenylhexa-2,4-dienamide
PubChem CID6449395
Molecular FormulaC12H13NO2
Molecular Weight203.24 g/mol
Exact Mass203.09
IUPAC Name(2E,4E)-6-hydroxy-6-phenylhexa-2,4-dienamide
SMILESNC(=O)/C=C/C=C/C(O)c1ccccc1
InChIInChI=1S/C12H13NO2/c13-12(15)9-5-4-8-11(14)10-6-2-1-3-7-10/h1-9,11,14H,(H2,13,15)/b8-4+,9-5+
InChIKeyURLWEJZUYQZEJB-KBXRYBNXSA-N
XLogP1.32
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

(Z)-1,4-diphenylbut-2-ene-1,4-diol
CID 12815414
(2S)-2-hydroxy-2-phenylacetaldehyde
CID 12536674
(E,1R,4R)-1-phenylpent-2-ene-1,4-diol
CID 131244712
(2E,4E)-5-(4-nitrophenyl)-1-phenylpenta-2,4-dien-1-ol
CID 23263855
ethyl (2Z,4E)-2-acetyloxy-6-hydroxy-6-phenylhexa-2,4-dienoate
CID 11415060
(2Z,4E)-1-(3-methylphenyl)-5-phenylpenta-2,4-dien-1-ol
CID 73292123
2-hydroxy-2-phenylacetamide;hydrochloride
CID 67718904
(Z)-4-fluoren-9-ylidenebut-2-enamide
CID 125485255
(Z)-1-phenylpent-2-en-4-yn-1-ol
CID 11008191
CID 135030986
CID 135030986
(E)-3-phenylprop-2-enamide;1-phenylpropylbenzene
CID 142088142
4-(3-methylphenyl)hepta-2,5-dienediamide
CID 54086053

Frequently Asked Questions

What is the IUPAC name of (2E,4E)-6-hydroxy-6-phenylhexa-2,4-dienamide?
The IUPAC name of (2E,4E)-6-hydroxy-6-phenylhexa-2,4-dienamide (CID 6449395) is (2E,4E)-6-hydroxy-6-phenylhexa-2,4-dienamide.
What is the SMILES notation for (2E,4E)-6-hydroxy-6-phenylhexa-2,4-dienamide?
The canonical SMILES for (2E,4E)-6-hydroxy-6-phenylhexa-2,4-dienamide is NC(=O)/C=C/C=C/C(O)c1ccccc1.
What is the InChIKey of (2E,4E)-6-hydroxy-6-phenylhexa-2,4-dienamide?
The InChIKey is URLWEJZUYQZEJB-KBXRYBNXSA-N. The full InChI is InChI=1S/C12H13NO2/c13-12(15)9-5-4-8-11(14)10-6-2-1-3-7-10/h1-9,11,14H,(H2,13,15)/b8-4+,9-5+.
What are the key properties of (2E,4E)-6-hydroxy-6-phenylhexa-2,4-dienamide?
(2E,4E)-6-hydroxy-6-phenylhexa-2,4-dienamide has a molecular weight of 203.24 g/mol, XLogP of 1.32, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,4E)-6-hydroxy-6-phenylhexa-2,4-dienamide is sourced from PubChem (CID 6449395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).