2-[(2-phenoxyacetyl)amino]-N-[[(E)-3-phenylprop-2-enylidene]amino]acetamide

C19H19N3O3 — CID 11979311

IUPAC2-[(2-phenoxyacetyl)amino]-N-[[(E)-3-phenylprop-2-enylidene]amino]acetamide
SMILESO=C(COc1ccccc1)NCC(=O)NN=C/C=C/c1ccccc1
InChIInChI=1S/C19H19N3O3/c23-18(22-21-13-7-10-16-8-3-1-4-9-16)14-20-19(24)15-25-17-11-5-2-6-12-17/h1-13H,14-15H2,(H,20,24)(H,22,23)/b10-7+,21-13?
InChIKeyMWCOAJZZIJBQMA-YFUFRYBISA-N
MW337.38 g/mol
LogP2.00
Rot. Bonds8

About 2-[(2-phenoxyacetyl)amino]-N-[[(E)-3-phenylprop-2-enylidene]amino]acetamide

2-[(2-phenoxyacetyl)amino]-N-[[(E)-3-phenylprop-2-enylidene]amino]acetamide (PubChem CID 11979311) has the molecular formula C19H19N3O3 and a molecular weight of 337.38 g/mol. Its IUPAC name is 2-[(2-phenoxyacetyl)amino]-N-[[(E)-3-phenylprop-2-enylidene]amino]acetamide.

Molecular Properties

Compound Name2-[(2-phenoxyacetyl)amino]-N-[[(E)-3-phenylprop-2-enylidene]amino]acetamide
PubChem CID11979311
Molecular FormulaC19H19N3O3
Molecular Weight337.38 g/mol
Exact Mass337.14
IUPAC Name2-[(2-phenoxyacetyl)amino]-N-[[(E)-3-phenylprop-2-enylidene]amino]acetamide
SMILESO=C(COc1ccccc1)NCC(=O)NN=C/C=C/c1ccccc1
InChIInChI=1S/C19H19N3O3/c23-18(22-21-13-7-10-16-8-3-1-4-9-16)14-20-19(24)15-25-17-11-5-2-6-12-17/h1-13H,14-15H2,(H,20,24)(H,22,23)/b10-7+,21-13?
InChIKeyMWCOAJZZIJBQMA-YFUFRYBISA-N
XLogP2.00
TPSA79.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-[[2-(2-methylphenoxy)acetyl]amino]-N-[(E)-[(E)-3-phenylprop-2-enylidene]amino]acetamide
CID 6875330
N-(cinnamylideneamino)-2-(4-phenylphenoxy)acetamide
CID 4198781
N-(benzylideneamino)-2-[(2-phenoxyacetyl)amino]acetamide
CID 3520224
2-(4-bromophenoxy)-N-[[(E)-3-phenylprop-2-enylidene]amino]acetamide
CID 129438781
N-(but-2-enylideneamino)-2-phenoxyacetamide
CID 4285683
N-[2-(2-cinnamylidenehydrazinyl)-2-oxoethyl]-2,2-diphenylacetamide
CID 4598701
N-[(Z)-(4-methoxyphenyl)methylideneamino]-2-[(2-phenoxyacetyl)amino]acetamide
CID 6110034
2-(2-phenylphenoxy)-N-[(Z)-[(E)-3-phenylprop-2-enylidene]amino]acetamide
CID 7744227
2-(2-methylphenoxy)-N-[(Z)-[(E)-3-phenylprop-2-enylidene]amino]acetamide
CID 6252134
N-(cinnamylideneamino)-2-naphthalen-1-yloxyacetamide
CID 3883435
N-[2-(2-cinnamylidenehydrazinyl)-2-oxoethyl]-2-iodobenzamide
CID 3859699
N-(cinnamylideneamino)-2-phenylacetamide
CID 562559

Frequently Asked Questions

What is the IUPAC name of 2-[(2-phenoxyacetyl)amino]-N-[[(E)-3-phenylprop-2-enylidene]amino]acetamide?
The IUPAC name of 2-[(2-phenoxyacetyl)amino]-N-[[(E)-3-phenylprop-2-enylidene]amino]acetamide (CID 11979311) is 2-[(2-phenoxyacetyl)amino]-N-[[(E)-3-phenylprop-2-enylidene]amino]acetamide.
What is the SMILES notation for 2-[(2-phenoxyacetyl)amino]-N-[[(E)-3-phenylprop-2-enylidene]amino]acetamide?
The canonical SMILES for 2-[(2-phenoxyacetyl)amino]-N-[[(E)-3-phenylprop-2-enylidene]amino]acetamide is O=C(COc1ccccc1)NCC(=O)NN=C/C=C/c1ccccc1.
What is the InChIKey of 2-[(2-phenoxyacetyl)amino]-N-[[(E)-3-phenylprop-2-enylidene]amino]acetamide?
The InChIKey is MWCOAJZZIJBQMA-YFUFRYBISA-N. The full InChI is InChI=1S/C19H19N3O3/c23-18(22-21-13-7-10-16-8-3-1-4-9-16)14-20-19(24)15-25-17-11-5-2-6-12-17/h1-13H,14-15H2,(H,20,24)(H,22,23)/b10-7+,21-13?.
What are the key properties of 2-[(2-phenoxyacetyl)amino]-N-[[(E)-3-phenylprop-2-enylidene]amino]acetamide?
2-[(2-phenoxyacetyl)amino]-N-[[(E)-3-phenylprop-2-enylidene]amino]acetamide has a molecular weight of 337.38 g/mol, XLogP of 2.00, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-phenoxyacetyl)amino]-N-[[(E)-3-phenylprop-2-enylidene]amino]acetamide is sourced from PubChem (CID 11979311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).