2-Pyrazinoylguanidine
Basic information
- CAS
60398-24-5- Standard SMILES
NC(N)=NC(=O)c1cnccn1- InChIKey
WNBSDCKJFDZMHT-UHFFFAOYSA-N- Molecular formula
- C6H7N5O
- Average molar mass
- 165.15 g/mol
- Monoisotopic mass
- 165.06505986
Overview
2-Pyrazinoylguanidine is a member of pyrazines.
Names & identifiers
- Preferred name
- 2-Pyrazinoylguanidine
- IUPAC
- N-(diaminomethylidene)pyrazine-2-carboxamide
- English name
- 2-pyrazinoylguanidine
- Molecular formula
- C6H7N5O
- Molecular weight
- 165.15
Names & synonyms
2-Pyrazinoylguanidine60398-24-5pyrazinoylguanidineG15V730JCMPyrazinecarboxamide, N-(aminoiminomethyl)-DTXSID40209151RefChem:910250DTXCID60131642N-carbamimidoylpyrazine-2-carboxamideN-(diaminomethylidene)pyrazine-2-carboxamideN-(Pyrazine-2-carbonyl)-guanidineCHEMBL1911974
Show more names
MFCD008980332-Pyrazinecarboxamide, N-(aminoiminomethyl)-UNII-G15V730JCMSCHEMBL565773SCHEMBL565774orb3174686CHEMBL1962516SCHEMBL29687671
Database identifiers
- CAS
60398-24-5- PubChem CID
- 124704
- DTXSID
DTXSID40209151- ChEMBL
CHEMBL1911974、CHEMBL1962516- ChEBI
CHEBI:230245- UNII
- G15V730JCM
- Nikkaji
- J485.977D
Properties
Computed structural properties
- XLogP
- -0.6
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 198
Physicochemical properties
- Density
- 1.56 · 1.56±0.1 g/cm3(Predicted)
- pka
- 10.18 · 10.18±0.46(Predicted)
- FDA UNII
- 15 V730JCM · G15V730JCM
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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