2-(naphthalen-1-ylamino)-N-[(E)-pyridin-2-ylmethylideneamino]acetamide

HCID 6887635

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Basic information

CAS: 328546-03-8
Standard SMILES: O=C(CNc1cccc2ccccc12)N/N=C/c1ccccn1
InChIKey: DBNWWYYLYYRALC-CIAFOILYSA-N
Molecular formula: C18H16N4O
Average molar mass: 304.3 g/mol
Monoisotopic mass: 304.13241115

Names & identifiers

Preferred name: 2-(naphthalen-1-ylamino)-N-[(E)-pyridin-2-ylmethylideneamino]acetamide
IUPAC: 2-(naphthalen-1-ylamino)-N-[(E)-pyridin-2-ylmethylideneamino]acetamide

Names & synonyms

MLS000768734CHEMBL3192261DTXSID301329438STK8700132-(naphthalen-1-ylamino)-N-[(E)-pyridin-2-ylmethylideneamino]acetamideAKOS001611192328546-03-8SMR000432052(E)-2-(naphthalen-1-ylamino)-N'-(pyridin-2-ylmethylene)acetohydrazide(Naphthalen-1-ylamino)-acetic acid [1-pyridin-2-yl-meth-(E)-ylidene]-hydrazide2-[(Naphthalen-1-yl)amino]-N'-[(E)-(pyridin-2-yl)methylidene]acetohydrazide2-(naphthalen-1-ylamino)-N'-[(E)-pyridin-2-ylmethylidene]acetohydrazide (non-preferred name)

Database identifiers

CAS: 328546-03-8
PubChem CID: 6887635
DTXSID: DTXSID301329438
ChEMBL: CHEMBL3192261

Properties

Computed structural properties

XLogP: 3.4
Topological polar surface area: 66.4 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 4
Rotatable bonds: 5
Heavy atoms: 23
Formal charge: 0
Complexity: 412

Experimental & physicochemical properties

Solubility38.7 [ug/mL] (The mean of the results at pH 7.4)

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