2-(5-aminotetrazol-1-yl)-N-[(E)-(6-methylpyridin-2-yl)methylideneamino]acetamide
Basic information
- CAS
347900-39-4- Standard SMILES
Cc1cccc(/C=N/NC(=O)Cn2nnnc2N)n1- InChIKey
PPWVCBCEIRQNFW-LFYBBSHMSA-N- Molecular formula
- C10H12N8O
- Average molar mass
- 260.26 g/mol
- Monoisotopic mass
- 260.11340704
Names & identifiers
- Preferred name
- 2-(5-aminotetrazol-1-yl)-N-[(E)-(6-methylpyridin-2-yl)methylideneamino]acetamide
- IUPAC
- 2-(5-aminotetrazol-1-yl)-N-[(E)-(6-methyl-2-pyridinyl)methylideneamino]acetamide
Names & synonyms
2-(5-amino-1H-tetrazol-1-yl)-N'-[(E)-(6-methylpyridin-2-yl)methylidene]acetohydrazide2-(5-aminotetrazol-1-yl)-N-[(E)-(6-methylpyridin-2-yl)methylideneamino]acetamide347900-39-4MLS000780214CHEMBL3196044DTXSID301328004STK539095AKOS005469543SMR000420397(E)-2-(5-amino-1H-tetrazol-1-yl)-N'-((6-methylpyridin-2-yl)methylene)acetohydrazide(5-Amino-tetrazol-1-yl)-acetic acid [1-(6-methyl-pyridin-2-yl)-meth-(E)-ylidene]-hydrazide
Database identifiers
- CAS
347900-39-4- PubChem CID
- 6884580
- DTXSID
DTXSID301328004- ChEMBL
CHEMBL3196044
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 124 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 335
Experimental & physicochemical properties
Solubility23.5 [ug/mL] (The mean of the results at pH 7.4)
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Compound notes
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