2-(4-methoxyphenoxy)-N-[(E)-pyridin-4-ylmethylideneamino]acetamide

C15H15N3O3 — CID 6898614

IUPAC2-(4-methoxyphenoxy)-N-[(E)-pyridin-4-ylmethylideneamino]acetamide
SMILESCOc1ccc(OCC(=O)N/N=C/c2ccncc2)cc1
InChIInChI=1S/C15H15N3O3/c1-20-13-2-4-14(5-3-13)21-11-15(19)18-17-10-12-6-8-16-9-7-12/h2-10H,11H2,1H3,(H,18,19)/b17-10+
InChIKeyBTZUPUCEDJRPJW-LICLKQGHSA-N
MW285.30 g/mol
LogP1.62
Rot. Bonds6

About 2-(4-methoxyphenoxy)-N-[(E)-pyridin-4-ylmethylideneamino]acetamide

2-(4-methoxyphenoxy)-N-[(E)-pyridin-4-ylmethylideneamino]acetamide (PubChem CID 6898614) has the molecular formula C15H15N3O3 and a molecular weight of 285.30 g/mol. Its IUPAC name is 2-(4-methoxyphenoxy)-N-[(E)-pyridin-4-ylmethylideneamino]acetamide.

Molecular Properties

Compound Name2-(4-methoxyphenoxy)-N-[(E)-pyridin-4-ylmethylideneamino]acetamide
PubChem CID6898614
Molecular FormulaC15H15N3O3
Molecular Weight285.30 g/mol
Exact Mass285.11
IUPAC Name2-(4-methoxyphenoxy)-N-[(E)-pyridin-4-ylmethylideneamino]acetamide
SMILESCOc1ccc(OCC(=O)N/N=C/c2ccncc2)cc1
InChIInChI=1S/C15H15N3O3/c1-20-13-2-4-14(5-3-13)21-11-15(19)18-17-10-12-6-8-16-9-7-12/h2-10H,11H2,1H3,(H,18,19)/b17-10+
InChIKeyBTZUPUCEDJRPJW-LICLKQGHSA-N
XLogP1.62
TPSA72.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.30
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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

N'-[(E)-(4-methoxyphenyl)methylidene]pyridine-4-carbohydrazide
CID 5390727
N-Pyridin-4-yl-2-p-tolyloxy-acetamide
CID 572152
2-(2-methylphenoxy)-N-(3-pyridinylmethyl)propanamide
CID 2977532
2-(3-methylphenoxy)-N-(4-pyridinyl)acetamide
CID 814788
1-(3-ethyl-5-hydroxy-5-pyridin-4-yl-4H-pyrazol-1-yl)-2-phenoxyethanone
CID 3136719
N-Pyridin-4-yl-2-o-tolyloxy-acetamide
CID 1101312
2-[4-(4-methylphenoxy)phenoxy]-N-pyridin-4-ylacetamide
CID 2318546
2-[4-(4-cyanophenyl)phenoxy]-N-(pyridin-4-ylmethylideneamino)acetamide
CID 2404738
2-[(2-phenoxyacetyl)amino]-N-(pyridin-3-ylmethyl)acetamide
CID 2524533
N-[(E)-(4-isopentyloxyphenyl)methyleneamino]pyridine-4-carboxamide
CID 6035218
3-(4-propan-2-yloxyphenyl)-N-[(E)-pyridin-4-ylmethylideneamino]propanamide
CID 6882354
N-[1-Pyridin-3-yl-meth-(E)-ylidene-hydrazinocarbonylmethyl]-2-m-tolyloxy-acetamide
CID 6882598

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenoxy)-N-[(E)-pyridin-4-ylmethylideneamino]acetamide?
The IUPAC name of 2-(4-methoxyphenoxy)-N-[(E)-pyridin-4-ylmethylideneamino]acetamide (CID 6898614) is 2-(4-methoxyphenoxy)-N-[(E)-pyridin-4-ylmethylideneamino]acetamide.
What is the SMILES notation for 2-(4-methoxyphenoxy)-N-[(E)-pyridin-4-ylmethylideneamino]acetamide?
The canonical SMILES for 2-(4-methoxyphenoxy)-N-[(E)-pyridin-4-ylmethylideneamino]acetamide is COc1ccc(OCC(=O)N/N=C/c2ccncc2)cc1.
What is the InChIKey of 2-(4-methoxyphenoxy)-N-[(E)-pyridin-4-ylmethylideneamino]acetamide?
The InChIKey is BTZUPUCEDJRPJW-LICLKQGHSA-N. The full InChI is InChI=1S/C15H15N3O3/c1-20-13-2-4-14(5-3-13)21-11-15(19)18-17-10-12-6-8-16-9-7-12/h2-10H,11H2,1H3,(H,18,19)/b17-10+.
What are the key properties of 2-(4-methoxyphenoxy)-N-[(E)-pyridin-4-ylmethylideneamino]acetamide?
2-(4-methoxyphenoxy)-N-[(E)-pyridin-4-ylmethylideneamino]acetamide has a molecular weight of 285.30 g/mol, XLogP of 1.62, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenoxy)-N-[(E)-pyridin-4-ylmethylideneamino]acetamide is sourced from PubChem (CID 6898614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).