(Z)-2-acetamido-3-phenyl-N-(2-phenylmethoxyphenyl)prop-2-enamide

C24H22N2O3 — CID 17093528

IUPAC(Z)-2-acetamido-3-phenyl-N-(2-phenylmethoxyphenyl)prop-2-enamide
SMILESCC(=O)N/C(=C\c1ccccc1)C(=O)Nc1ccccc1OCc1ccccc1
InChIInChI=1S/C24H22N2O3/c1-18(27)25-22(16-19-10-4-2-5-11-19)24(28)26-21-14-8-9-15-23(21)29-17-20-12-6-3-7-13-20/h2-16H,17H2,1H3,(H,25,27)(H,26,28)/b22-16-
InChIKeyOJCADHIIEOFBJI-JWGURIENSA-N
MW386.45 g/mol
LogP4.38
Rot. Bonds7

About (Z)-2-acetamido-3-phenyl-N-(2-phenylmethoxyphenyl)prop-2-enamide

(Z)-2-acetamido-3-phenyl-N-(2-phenylmethoxyphenyl)prop-2-enamide (PubChem CID 17093528) has the molecular formula C24H22N2O3 and a molecular weight of 386.45 g/mol. Its IUPAC name is (Z)-2-acetamido-3-phenyl-N-(2-phenylmethoxyphenyl)prop-2-enamide.

Molecular Properties

Compound Name(Z)-2-acetamido-3-phenyl-N-(2-phenylmethoxyphenyl)prop-2-enamide
PubChem CID17093528
Molecular FormulaC24H22N2O3
Molecular Weight386.45 g/mol
Exact Mass386.16
IUPAC Name(Z)-2-acetamido-3-phenyl-N-(2-phenylmethoxyphenyl)prop-2-enamide
SMILESCC(=O)N/C(=C\c1ccccc1)C(=O)Nc1ccccc1OCc1ccccc1
InChIInChI=1S/C24H22N2O3/c1-18(27)25-22(16-19-10-4-2-5-11-19)24(28)26-21-14-8-9-15-23(21)29-17-20-12-6-3-7-13-20/h2-16H,17H2,1H3,(H,25,27)(H,26,28)/b22-16-
InChIKeyOJCADHIIEOFBJI-JWGURIENSA-N
XLogP4.38
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.45
LogP ≤ 54.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[(2-acetamido-3-phenylprop-2-enoyl)amino]benzoic acid
CID 139795518
2-acetamido-N-(2-hydroxyphenyl)-3-phenylprop-2-enamide
CID 4947897
(Z)-2-acetamido-N-(2-chlorophenyl)-3-phenylprop-2-enamide
CID 21226623
2-acetamido-N-(2-ethoxyphenyl)-3-(3-nitrophenyl)prop-2-enamide
CID 4926261
[4-[(Z)-2-acetamido-3-(2-ethoxyanilino)-3-oxoprop-1-enyl]-2-methoxyphenyl] acetate
CID 2272784
2-acetamido-N-(4-acetamidophenyl)-3-phenylprop-2-enamide
CID 3527723
4-methyl-3-oxo-N-(2-phenylmethoxyphenyl)-2-(pyridin-4-ylmethylidene)pentanamide
CID 90714269
(E)-3-hydroxy-2-phenyldiazenyl-N-(2-phenylmethoxyphenyl)but-2-enamide
CID 178130112
(Z)-2-acetamido-3-phenyl-N-(4-propoxyphenyl)prop-2-enamide
CID 8767931
N-(3-hydrazinyl-3-oxo-1-phenylprop-1-en-2-yl)acetamide
CID 53412410
(Z)-2-acetamido-3-phenyl-N-(4-phenylphenyl)prop-2-enamide
CID 9206311
(Z)-2-acetamido-N-(4-methoxyphenyl)-3-phenylprop-2-enamide
CID 5371270

Frequently Asked Questions

What is the IUPAC name of (Z)-2-acetamido-3-phenyl-N-(2-phenylmethoxyphenyl)prop-2-enamide?
The IUPAC name of (Z)-2-acetamido-3-phenyl-N-(2-phenylmethoxyphenyl)prop-2-enamide (CID 17093528) is (Z)-2-acetamido-3-phenyl-N-(2-phenylmethoxyphenyl)prop-2-enamide.
What is the SMILES notation for (Z)-2-acetamido-3-phenyl-N-(2-phenylmethoxyphenyl)prop-2-enamide?
The canonical SMILES for (Z)-2-acetamido-3-phenyl-N-(2-phenylmethoxyphenyl)prop-2-enamide is CC(=O)N/C(=C\c1ccccc1)C(=O)Nc1ccccc1OCc1ccccc1.
What is the InChIKey of (Z)-2-acetamido-3-phenyl-N-(2-phenylmethoxyphenyl)prop-2-enamide?
The InChIKey is OJCADHIIEOFBJI-JWGURIENSA-N. The full InChI is InChI=1S/C24H22N2O3/c1-18(27)25-22(16-19-10-4-2-5-11-19)24(28)26-21-14-8-9-15-23(21)29-17-20-12-6-3-7-13-20/h2-16H,17H2,1H3,(H,25,27)(H,26,28)/b22-16-.
What are the key properties of (Z)-2-acetamido-3-phenyl-N-(2-phenylmethoxyphenyl)prop-2-enamide?
(Z)-2-acetamido-3-phenyl-N-(2-phenylmethoxyphenyl)prop-2-enamide has a molecular weight of 386.45 g/mol, XLogP of 4.38, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-acetamido-3-phenyl-N-(2-phenylmethoxyphenyl)prop-2-enamide is sourced from PubChem (CID 17093528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).