2-(2-methoxyanilino)-N-(pyridin-3-ylmethylideneamino)acetamide

C15H16N4O2 — CID 717684

IUPAC2-(2-methoxyanilino)-N-(pyridin-3-ylmethylideneamino)acetamide
SMILESCOc1ccccc1NCC(=O)NN=Cc1cccnc1
InChIInChI=1S/C15H16N4O2/c1-21-14-7-3-2-6-13(14)17-11-15(20)19-18-10-12-5-4-8-16-9-12/h2-10,17H,11H2,1H3,(H,19,20)
InChIKeyZZXGKSAGOALFNW-UHFFFAOYSA-N
MW284.32 g/mol
LogP1.65
Rot. Bonds6

About 2-(2-methoxyanilino)-N-(pyridin-3-ylmethylideneamino)acetamide

2-(2-methoxyanilino)-N-(pyridin-3-ylmethylideneamino)acetamide (PubChem CID 717684) has the molecular formula C15H16N4O2 and a molecular weight of 284.32 g/mol. Its IUPAC name is 2-(2-methoxyanilino)-N-(pyridin-3-ylmethylideneamino)acetamide.

Molecular Properties

Compound Name2-(2-methoxyanilino)-N-(pyridin-3-ylmethylideneamino)acetamide
PubChem CID717684
Molecular FormulaC15H16N4O2
Molecular Weight284.32 g/mol
Exact Mass284.13
IUPAC Name2-(2-methoxyanilino)-N-(pyridin-3-ylmethylideneamino)acetamide
SMILESCOc1ccccc1NCC(=O)NN=Cc1cccnc1
InChIInChI=1S/C15H16N4O2/c1-21-14-7-3-2-6-13(14)17-11-15(20)19-18-10-12-5-4-8-16-9-12/h2-10,17H,11H2,1H3,(H,19,20)
InChIKeyZZXGKSAGOALFNW-UHFFFAOYSA-N
XLogP1.65
TPSA75.61 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 51.65
H-Bond Donors ≤ 52
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-methoxyanilino)-N-[(E)-(4-methoxyphenyl)methylideneamino]acetamide
CID 6910807
N-[(Z)-(4-hydroxy-3,5-diiodophenyl)methylideneamino]-2-(2-methoxyanilino)acetamide
CID 171985531
N-[(Z)-(3-fluoro-4-methoxyphenyl)methylideneamino]-2-(2-methoxyanilino)acetamide
CID 8974942
N-[(Z)-(4-ethoxyphenyl)methylideneamino]-2-(2-methoxyanilino)acetamide
CID 5401700
N-[(4-ethoxyphenyl)methylideneamino]-2-(2-methoxyanilino)acetamide
CID 759194
[2,6-dimethoxy-4-[(Z)-[[2-(2-methoxyanilino)acetyl]hydrazinylidene]methyl]phenyl] acetate
CID 7933428
N-[(E)-[4-(diethylamino)phenyl]methylideneamino]-2-(2-methoxyanilino)acetamide
CID 6910799
2-(2-tert-butylphenoxy)-N-[(E)-pyridin-3-ylmethylideneamino]acetamide
CID 19190191
2-(2-methoxyanilino)-N-[(E)-(2,4,6-trimethoxyphenyl)methylideneamino]acetamide
CID 6910859
2-(2-methoxyanilino)-N-[(E)-(2,4,6-trimethylphenyl)methylideneamino]acetamide
CID 6910847
N-[(Z)-(2-fluorophenyl)methylideneamino]-2-(2-methoxyanilino)acetamide
CID 5404184
2-(4-methoxyphenyl)-N-[(Z)-pyridin-3-ylmethylideneamino]acetamide
CID 5428272

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyanilino)-N-(pyridin-3-ylmethylideneamino)acetamide?
The IUPAC name of 2-(2-methoxyanilino)-N-(pyridin-3-ylmethylideneamino)acetamide (CID 717684) is 2-(2-methoxyanilino)-N-(pyridin-3-ylmethylideneamino)acetamide.
What is the SMILES notation for 2-(2-methoxyanilino)-N-(pyridin-3-ylmethylideneamino)acetamide?
The canonical SMILES for 2-(2-methoxyanilino)-N-(pyridin-3-ylmethylideneamino)acetamide is COc1ccccc1NCC(=O)NN=Cc1cccnc1.
What is the InChIKey of 2-(2-methoxyanilino)-N-(pyridin-3-ylmethylideneamino)acetamide?
The InChIKey is ZZXGKSAGOALFNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O2/c1-21-14-7-3-2-6-13(14)17-11-15(20)19-18-10-12-5-4-8-16-9-12/h2-10,17H,11H2,1H3,(H,19,20).
What are the key properties of 2-(2-methoxyanilino)-N-(pyridin-3-ylmethylideneamino)acetamide?
2-(2-methoxyanilino)-N-(pyridin-3-ylmethylideneamino)acetamide has a molecular weight of 284.32 g/mol, XLogP of 1.65, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyanilino)-N-(pyridin-3-ylmethylideneamino)acetamide is sourced from PubChem (CID 717684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).