2-(4-methoxyphenyl)-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide

C15H15N3O2 — CID 5428272

IUPAC2-(4-methoxyphenyl)-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide
SMILESCOc1ccc(CC(=O)N/N=C\c2cccnc2)cc1
InChIInChI=1S/C15H15N3O2/c1-20-14-6-4-12(5-7-14)9-15(19)18-17-11-13-3-2-8-16-10-13/h2-8,10-11H,9H2,1H3,(H,18,19)/b17-11-
InChIKeyLKABZLJGXMDCHA-BOPFTXTBSA-N
MW269.30 g/mol
LogP1.78
Rot. Bonds5

About 2-(4-methoxyphenyl)-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide

2-(4-methoxyphenyl)-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide (PubChem CID 5428272) has the molecular formula C15H15N3O2 and a molecular weight of 269.30 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide
PubChem CID5428272
Molecular FormulaC15H15N3O2
Molecular Weight269.30 g/mol
Exact Mass269.12
IUPAC Name2-(4-methoxyphenyl)-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide
SMILESCOc1ccc(CC(=O)N/N=C\c2cccnc2)cc1
InChIInChI=1S/C15H15N3O2/c1-20-14-6-4-12(5-7-14)9-15(19)18-17-11-13-3-2-8-16-10-13/h2-8,10-11H,9H2,1H3,(H,18,19)/b17-11-
InChIKeyLKABZLJGXMDCHA-BOPFTXTBSA-N
XLogP1.78
TPSA63.58 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 51.78
H-Bond Donors ≤ 51
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-(3-methoxyphenoxy)-N-[(E)-pyridin-3-ylmethylideneamino]acetamide
CID 19208665
N-[(4-hydroxyphenyl)methylideneamino]-2-(4-methoxyphenyl)acetamide
CID 968721
N,N'-bis(pyridin-3-ylmethylideneamino)pentanediamide
CID 4208581
2-(4-butylphenoxy)-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide
CID 6042930
3-methoxy-N-[2-oxo-2-[(2E)-2-(pyridin-3-ylmethylidene)hydrazinyl]ethyl]benzamide
CID 6881848
2-(4-aminophenyl)-N-[(Z)-(3-methoxyphenyl)methylideneamino]acetamide
CID 110515236
2-(2-methoxyanilino)-N-(pyridin-3-ylmethylideneamino)acetamide
CID 717684
N-[(E)-(3,4-dimethoxyphenyl)methylideneamino]-2-pyridin-3-ylacetamide
CID 19167941
2-(2-chlorophenyl)-N-[(E)-pyridin-3-ylmethylideneamino]acetamide
CID 25237213
2-[(2,5-dimethoxyphenyl)sulfonyl-methylamino]-N-[(E)-pyridin-3-ylmethylideneamino]acetamide
CID 93032624
2-(4-methoxyphenyl)-N-[(E)-(1-methylpyrrol-3-yl)methylideneamino]acetamide
CID 50853612
N-(pyridin-3-ylmethylideneamino)-2-thiophen-2-ylacetamide
CID 696915

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide?
The IUPAC name of 2-(4-methoxyphenyl)-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide (CID 5428272) is 2-(4-methoxyphenyl)-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide.
What is the SMILES notation for 2-(4-methoxyphenyl)-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide?
The canonical SMILES for 2-(4-methoxyphenyl)-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide is COc1ccc(CC(=O)N/N=C\c2cccnc2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide?
The InChIKey is LKABZLJGXMDCHA-BOPFTXTBSA-N. The full InChI is InChI=1S/C15H15N3O2/c1-20-14-6-4-12(5-7-14)9-15(19)18-17-11-13-3-2-8-16-10-13/h2-8,10-11H,9H2,1H3,(H,18,19)/b17-11-.
What are the key properties of 2-(4-methoxyphenyl)-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide?
2-(4-methoxyphenyl)-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide has a molecular weight of 269.30 g/mol, XLogP of 1.78, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide is sourced from PubChem (CID 5428272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).