Basic information
- Standard SMILES
O=C(O)CNC(=O)c1cn(-c2cccnc2)nn1- InChIKey
NUDQTCMFGTUMBI-UHFFFAOYSA-N- Molecular formula
- C10H9N5O3
- Average molar mass
- 247.21 g/mol
Names & identifiers
- Preferred name
- [(1-pyridin-3-yl-1H-[1,2,3]triazole-4-carbonyl)-amino]-acetic acid
- IUPAC
- 2-[(1-pyridin-3-yltriazole-4-carbonyl)amino]acetic acid
Names & synonyms
SCHEMBL71676NUDQTCMFGTUMBI-UHFFFAOYSA-N[(1-pyridin-3-yl-1H-[1,2,3]triazole-4-carbonyl)-amino]-acetic acid
Database identifiers
- PubChem CID
- 66592012
Properties
Computed structural properties
- XLogP
- -0.5
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 325
Related reactions
21 records
Compound notes
Loading…