(E)-3-phenyl-N-phenylmethoxyprop-2-enamide

C16H15NO2 — CID 5368484

IUPAC(E)-3-phenyl-N-phenylmethoxyprop-2-enamide
SMILESO=C(/C=C/c1ccccc1)NOCc1ccccc1
InChIInChI=1S/C16H15NO2/c18-16(12-11-14-7-3-1-4-8-14)17-19-13-15-9-5-2-6-10-15/h1-12H,13H2,(H,17,18)/b12-11+
InChIKeyHEIXGSVFRUODQQ-VAWYXSNFSA-N
MW253.30 g/mol
LogP2.95
Rot. Bonds5

About (E)-3-phenyl-N-phenylmethoxyprop-2-enamide

(E)-3-phenyl-N-phenylmethoxyprop-2-enamide (PubChem CID 5368484) has the molecular formula C16H15NO2 and a molecular weight of 253.30 g/mol. Its IUPAC name is (E)-3-phenyl-N-phenylmethoxyprop-2-enamide.

Molecular Properties

Compound Name(E)-3-phenyl-N-phenylmethoxyprop-2-enamide
PubChem CID5368484
Molecular FormulaC16H15NO2
Molecular Weight253.30 g/mol
Exact Mass253.11
IUPAC Name(E)-3-phenyl-N-phenylmethoxyprop-2-enamide
SMILESO=C(/C=C/c1ccccc1)NOCc1ccccc1
InChIInChI=1S/C16H15NO2/c18-16(12-11-14-7-3-1-4-8-14)17-19-13-15-9-5-2-6-10-15/h1-12H,13H2,(H,17,18)/b12-11+
InChIKeyHEIXGSVFRUODQQ-VAWYXSNFSA-N
XLogP2.95
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.30
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3(2H)-Isoxazolone, 5-phenyl-
CID 70318
N-Benzoyl-O-benzylhydroxylamine
CID 252925
(E)-N-hydroxy-3-[4-[(E)-phenylmethoxyiminomethyl]phenyl]prop-2-enamide
CID 11973766
N-Hydroxy-E-3-[4''-hydroxymethylbiphenyl-4-yl]-acrylamide
CID 15986506
3(2H)-Isoxazolone, 4-methyl-5-phenyl-
CID 3845653
(E)-4-(benzyloxyamino)-4-oxo-but-2-enoic acid
CID 6474831
1-(benzyloxy)pyridin-2(1H)-one
CID 824729
(E)-N-hydroxy-3-[4-[[4-(hydroxymethyl)phenyl]methyl]phenyl]prop-2-enamide
CID 76329682
5-(4-Methylphenyl)-1,2-oxazol-3-ol
CID 19596543
N-(Benzyloxy)-2,2,2-trifluoroacetamide
CID 10867762
2-Butenoic acid, 4-(benzyloxy)amino-4-oxo-
CID 467650
N-phenylmethoxyacetamide
CID 5129184

Frequently Asked Questions

What is the IUPAC name of (E)-3-phenyl-N-phenylmethoxyprop-2-enamide?
The IUPAC name of (E)-3-phenyl-N-phenylmethoxyprop-2-enamide (CID 5368484) is (E)-3-phenyl-N-phenylmethoxyprop-2-enamide.
What is the SMILES notation for (E)-3-phenyl-N-phenylmethoxyprop-2-enamide?
The canonical SMILES for (E)-3-phenyl-N-phenylmethoxyprop-2-enamide is O=C(/C=C/c1ccccc1)NOCc1ccccc1.
What is the InChIKey of (E)-3-phenyl-N-phenylmethoxyprop-2-enamide?
The InChIKey is HEIXGSVFRUODQQ-VAWYXSNFSA-N. The full InChI is InChI=1S/C16H15NO2/c18-16(12-11-14-7-3-1-4-8-14)17-19-13-15-9-5-2-6-10-15/h1-12H,13H2,(H,17,18)/b12-11+.
What are the key properties of (E)-3-phenyl-N-phenylmethoxyprop-2-enamide?
(E)-3-phenyl-N-phenylmethoxyprop-2-enamide has a molecular weight of 253.30 g/mol, XLogP of 2.95, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-phenyl-N-phenylmethoxyprop-2-enamide is sourced from PubChem (CID 5368484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).