2-(3-methoxyphenoxy)-N-[(E)-pyridin-3-ylmethylideneamino]acetamide

C15H15N3O3 — CID 19208665

IUPAC2-(3-methoxyphenoxy)-N-[(E)-pyridin-3-ylmethylideneamino]acetamide
SMILESCOc1cccc(OCC(=O)N/N=C/c2cccnc2)c1
InChIInChI=1S/C15H15N3O3/c1-20-13-5-2-6-14(8-13)21-11-15(19)18-17-10-12-4-3-7-16-9-12/h2-10H,11H2,1H3,(H,18,19)/b17-10+
InChIKeyVPXAOVZQDJQWCH-LICLKQGHSA-N
MW285.30 g/mol
LogP1.62
Rot. Bonds6

About 2-(3-methoxyphenoxy)-N-[(E)-pyridin-3-ylmethylideneamino]acetamide

2-(3-methoxyphenoxy)-N-[(E)-pyridin-3-ylmethylideneamino]acetamide (PubChem CID 19208665) has the molecular formula C15H15N3O3 and a molecular weight of 285.30 g/mol. Its IUPAC name is 2-(3-methoxyphenoxy)-N-[(E)-pyridin-3-ylmethylideneamino]acetamide.

Molecular Properties

Compound Name2-(3-methoxyphenoxy)-N-[(E)-pyridin-3-ylmethylideneamino]acetamide
PubChem CID19208665
Molecular FormulaC15H15N3O3
Molecular Weight285.30 g/mol
Exact Mass285.11
IUPAC Name2-(3-methoxyphenoxy)-N-[(E)-pyridin-3-ylmethylideneamino]acetamide
SMILESCOc1cccc(OCC(=O)N/N=C/c2cccnc2)c1
InChIInChI=1S/C15H15N3O3/c1-20-13-5-2-6-14(8-13)21-11-15(19)18-17-10-12-4-3-7-16-9-12/h2-10H,11H2,1H3,(H,18,19)/b17-10+
InChIKeyVPXAOVZQDJQWCH-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)-(3-hydroxyphenyl)methylideneamino]-2-(3-methoxyphenoxy)acetamide
CID 19208653
3-methoxy-N-[2-oxo-2-[(2E)-2-(pyridin-3-ylmethylidene)hydrazinyl]ethyl]benzamide
CID 6881848
4-[(E)-[[2-(3-methoxyphenoxy)acetyl]hydrazinylidene]methyl]benzoic acid
CID 19208670
2-(4-methoxyphenyl)-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide
CID 5428272
2-(3-methoxyphenoxy)-N-[(E)-(3-nitrophenyl)methylideneamino]acetamide
CID 19208624
2-(4-butylphenoxy)-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide
CID 6042930
2-(4-chloro-3,5-dimethylphenoxy)-N-[(Z)-(3-methoxyphenyl)methylideneamino]acetamide
CID 5419197
N-[(Z)-(3-methoxyphenyl)methylideneamino]-2-(4-propan-2-ylphenoxy)acetamide
CID 5420715
N-[(E)-(3-ethoxy-4-hydroxyphenyl)methylideneamino]-2-(3-methoxyphenoxy)acetamide
CID 135805040
2-(2-chlorophenoxy)-N-[(E)-pyridin-3-ylmethylideneamino]acetamide
CID 6863841
2-(2-tert-butylphenoxy)-N-[(E)-pyridin-3-ylmethylideneamino]acetamide
CID 19190191
N-[(3,5-dimethoxyphenyl)methylideneamino]-2-(4-methoxyphenoxy)acetamide
CID 4236788

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenoxy)-N-[(E)-pyridin-3-ylmethylideneamino]acetamide?
The IUPAC name of 2-(3-methoxyphenoxy)-N-[(E)-pyridin-3-ylmethylideneamino]acetamide (CID 19208665) is 2-(3-methoxyphenoxy)-N-[(E)-pyridin-3-ylmethylideneamino]acetamide.
What is the SMILES notation for 2-(3-methoxyphenoxy)-N-[(E)-pyridin-3-ylmethylideneamino]acetamide?
The canonical SMILES for 2-(3-methoxyphenoxy)-N-[(E)-pyridin-3-ylmethylideneamino]acetamide is COc1cccc(OCC(=O)N/N=C/c2cccnc2)c1.
What is the InChIKey of 2-(3-methoxyphenoxy)-N-[(E)-pyridin-3-ylmethylideneamino]acetamide?
The InChIKey is VPXAOVZQDJQWCH-LICLKQGHSA-N. The full InChI is InChI=1S/C15H15N3O3/c1-20-13-5-2-6-14(8-13)21-11-15(19)18-17-10-12-4-3-7-16-9-12/h2-10H,11H2,1H3,(H,18,19)/b17-10+.
What are the key properties of 2-(3-methoxyphenoxy)-N-[(E)-pyridin-3-ylmethylideneamino]acetamide?
2-(3-methoxyphenoxy)-N-[(E)-pyridin-3-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-(3-methoxyphenoxy)-N-[(E)-pyridin-3-ylmethylideneamino]acetamide is sourced from PubChem (CID 19208665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).