Basic information
- CAS
67026-38-4- Standard SMILES
CCOCCN=C(NC#N)Nc1cccnc1- InChIKey
VEDZWQOIUMRKAJ-UHFFFAOYSA-N- Molecular formula
- C11H15N5O
- Average molar mass
- 233.27 g/mol
- Monoisotopic mass
- 233.12766012
Names & identifiers
- Preferred name
- Guanidine, 2-cyano-1-(2-ethoxyethyl)-3-(3-pyridyl)-
- IUPAC
- 1-cyano-2-(2-ethoxyethyl)-3-pyridin-3-ylguanidine
- English name
- 2-Cyano-1-(2-ethoxyethyl)-3-(3-pyridyl)guanidine
- Molecular weight
- 0
Names & synonyms
BRN 041279267026-38-4GUANIDINE, 2-CYANO-1-(2-ETHOXYETHYL)-3-(3-PYRIDYL)-2-Cyano-1-(2-ethoxyethyl)-3-(3-pyridyl)guanidineDTXSID60217253RefChem:346944DTXCID60139744CHEMBL316196N-Cyano-N''-(2-ethoxyethyl)-N'-(pyridin-3-yl)guanidine
Database identifiers
- CAS
67026-38-4- PubChem CID
- 48865
- DTXSID
DTXSID60217253- ChEMBL
CHEMBL316196- Nikkaji
- J78.469I
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 82.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 283
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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