2,5-dimethoxy-N-[(Z)-pyridin-2-ylmethylideneamino]benzamide

C15H15N3O3 — CID 5414466

IUPAC2,5-dimethoxy-N-[(Z)-pyridin-2-ylmethylideneamino]benzamide
SMILESCOc1ccc(OC)c(C(=O)N/N=C\c2ccccn2)c1
InChIInChI=1S/C15H15N3O3/c1-20-12-6-7-14(21-2)13(9-12)15(19)18-17-10-11-5-3-4-8-16-11/h3-10H,1-2H3,(H,18,19)/b17-10-
InChIKeyKNCGGVGSVKXHKC-YVLHZVERSA-N
MW285.30 g/mol
LogP1.86
Rot. Bonds5

About 2,5-dimethoxy-N-[(Z)-pyridin-2-ylmethylideneamino]benzamide

2,5-dimethoxy-N-[(Z)-pyridin-2-ylmethylideneamino]benzamide (PubChem CID 5414466) has the molecular formula C15H15N3O3 and a molecular weight of 285.30 g/mol. Its IUPAC name is 2,5-dimethoxy-N-[(Z)-pyridin-2-ylmethylideneamino]benzamide.

Molecular Properties

Compound Name2,5-dimethoxy-N-[(Z)-pyridin-2-ylmethylideneamino]benzamide
PubChem CID5414466
Molecular FormulaC15H15N3O3
Molecular Weight285.30 g/mol
Exact Mass285.11
IUPAC Name2,5-dimethoxy-N-[(Z)-pyridin-2-ylmethylideneamino]benzamide
SMILESCOc1ccc(OC)c(C(=O)N/N=C\c2ccccn2)c1
InChIInChI=1S/C15H15N3O3/c1-20-12-6-7-14(21-2)13(9-12)15(19)18-17-10-11-5-3-4-8-16-11/h3-10H,1-2H3,(H,18,19)/b17-10-
InChIKeyKNCGGVGSVKXHKC-YVLHZVERSA-N
XLogP1.86
TPSA72.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.30
LogP ≤ 51.86
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

2-(2,4-dimethoxyphenyl)-N-[(E)-pyridin-2-ylmethylideneamino]quinoline-4-carboxamide
CID 6875005
2-methoxy-N-[2-oxo-2-[2-(pyridin-2-ylmethylidene)hydrazinyl]ethyl]benzamide
CID 3097740
2-(4-methoxyphenoxy)-N-[(Z)-pyridin-2-ylmethylideneamino]acetamide
CID 5425519
N'-(2,5-dimethoxybenzoyl)pyridine-2-carbohydrazide
CID 8573468
N-[(3-methoxyphenyl)methylideneamino]pyridine-2-carboxamide
CID 761649
2-chloro-N-[(E)-pyridin-2-ylmethylideneamino]benzamide;dihydrate
CID 139147248
N-[1-(2,5-dimethoxyphenyl)ethylideneamino]pyridine-2-carboxamide
CID 5238816
3-[(4-methoxyphenyl)sulfamoyl]-N-[(E)-pyridin-2-ylmethylideneamino]benzamide
CID 6904564
N-[(2,4-dimethoxyphenyl)methylideneamino]-3-methoxynaphthalene-2-carboxamide
CID 3422870
2-methoxy-N-[(E)-(4-methoxyphenyl)methylideneamino]benzamide
CID 6861691
(2S)-2-(4-methylphenoxy)-N-(pyridin-2-ylmethylideneamino)propanamide
CID 706969
N-[(Z)-(4-ethoxy-3-methoxyphenyl)methylideneamino]-2,4-dimethoxybenzamide
CID 6134975

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethoxy-N-[(Z)-pyridin-2-ylmethylideneamino]benzamide?
The IUPAC name of 2,5-dimethoxy-N-[(Z)-pyridin-2-ylmethylideneamino]benzamide (CID 5414466) is 2,5-dimethoxy-N-[(Z)-pyridin-2-ylmethylideneamino]benzamide.
What is the SMILES notation for 2,5-dimethoxy-N-[(Z)-pyridin-2-ylmethylideneamino]benzamide?
The canonical SMILES for 2,5-dimethoxy-N-[(Z)-pyridin-2-ylmethylideneamino]benzamide is COc1ccc(OC)c(C(=O)N/N=C\c2ccccn2)c1.
What is the InChIKey of 2,5-dimethoxy-N-[(Z)-pyridin-2-ylmethylideneamino]benzamide?
The InChIKey is KNCGGVGSVKXHKC-YVLHZVERSA-N. The full InChI is InChI=1S/C15H15N3O3/c1-20-12-6-7-14(21-2)13(9-12)15(19)18-17-10-11-5-3-4-8-16-11/h3-10H,1-2H3,(H,18,19)/b17-10-.
What are the key properties of 2,5-dimethoxy-N-[(Z)-pyridin-2-ylmethylideneamino]benzamide?
2,5-dimethoxy-N-[(Z)-pyridin-2-ylmethylideneamino]benzamide has a molecular weight of 285.30 g/mol, XLogP of 1.86, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethoxy-N-[(Z)-pyridin-2-ylmethylideneamino]benzamide is sourced from PubChem (CID 5414466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).