Basic information
- CAS
329922-36-3- Standard SMILES
NCCNC(=O)c1nonc1N- InChIKey
GMAOXGYMUZIHOQ-UHFFFAOYSA-N- Molecular formula
- C5H9N5O2
- Average molar mass
- 171.16 g/mol
- Monoisotopic mass
- 171.07562455
Names & identifiers
- Preferred name
- 4-Amino-N-(2-aminoethyl)-1,2,5-oxadiazole-3-carboxamide
- IUPAC
- 4-amino-N-(2-aminoethyl)-1,2,5-oxadiazole-3-carboxamide
Names & synonyms
4-Amino-N-(2-aminoethyl)-1,2,5-oxadiazole-3-carboxamide329922-36-3DTXSID50336846RefChem:290071DTXCID402879341228070-89-01,2,5-Oxadiazole-3-carboxamide, 4-amino-N-(2-aminoethyl)-(4-amino(1,2,5-oxadiazol-3-yl))-N-(2-aminoethyl)carboxamide4-Amino-N-3'-(2-aminoethyl)-1,2,5-oxadiazole-3-carboxamideOprea1_634824Oprea1_674683GMAOXGYMUZIHOQ-UHFFFAOYSA-N
Show more names
ALBB-023383MFCD00823190SBB000170STK064780AKOS000288797ST006405DB-336929SR-01000513075
Database identifiers
- CAS
329922-36-3- PubChem CID
- 536746
- DTXSID
DTXSID50336846
Properties
Computed structural properties
- XLogP
- -1.4
- Topological polar surface area
- 120 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 164
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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