Basic information
- CAS
67026-39-5- Standard SMILES
CCN(CC)CCN=C(NC#N)Nc1cccnc1- InChIKey
HUEOMNMLMZBNKJ-UHFFFAOYSA-N- Molecular formula
- C13H20N6
- Average molar mass
- 260.34 g/mol
- Monoisotopic mass
- 260.17494466
Names & identifiers
- Preferred name
- Guanidine, 2-cyano-1-(2-diethylaminoethyl)-3-(3-pyridyl)-
- IUPAC
- 1-cyano-2-[2-(diethylamino)ethyl]-3-pyridin-3-ylguanidine
- English name
- 2-Cyano-1-(2-diethylaminoethyl)-3-(3-pyridyl)guanidine
- Molecular weight
- 0
Names & synonyms
BRN 041914967026-39-5GUANIDINE, 2-CYANO-1-(2-DIETHYLAMINOETHYL)-3-(3-PYRIDYL)-2-Cyano-1-(2-diethylaminoethyl)-3-(3-pyridyl)guanidineDTXSID20217254RefChem:346943DTXCID20139745CHEMBL84729N-Cyano-N''-[2-(diethylamino)ethyl]-N'-(pyridin-3-yl)guanidine
Database identifiers
- CAS
67026-39-5- PubChem CID
- 48866
- DTXSID
DTXSID20217254- ChEMBL
CHEMBL84729- Nikkaji
- J78.465F
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 76.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 314
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…