Guanidine, N-cyano-N'-(1-phenylpropyl)-N''-3-pyridinyl-
Basic information
- CAS
155342-61-3- Standard SMILES
CCC(N=C(NC#N)Nc1cccnc1)c1ccccc1- InChIKey
FOECJWCTYWHHFA-UHFFFAOYSA-N- Molecular formula
- C16H17N5
- Average molar mass
- 279.34 g/mol
- Monoisotopic mass
- 279.14839556
Names & identifiers
- Preferred name
- Guanidine, N-cyano-N'-(1-phenylpropyl)-N''-3-pyridinyl-
- IUPAC
- 1-cyano-2-(1-phenylpropyl)-3-pyridin-3-ylguanidine
Names & synonyms
155342-61-3Guanidine, N-cyano-N'-(1-phenylpropyl)-N''-3-pyridinyl-SCHEMBL7349440SCHEMBL7356807SCHEMBL7356810DTXSID10431260FOECJWCTYWHHFA-UHFFFAOYSA-NN"-Cyano-N-(3-pyridyl)-N'-(1-phenyl)propylguanidineN-Cyano-N''-(1-phenylpropyl)-N'-(pyridin-3-yl)guanidine
Database identifiers
- CAS
155342-61-3- PubChem CID
- 9817136
- DTXSID
DTXSID10431260
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 73.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 377
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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