Basic information
- CAS
67026-52-2- Standard SMILES
N#CNC(=NC1CCCCC1)Nc1ccncc1- InChIKey
DGOVGODHTGREPB-UHFFFAOYSA-N- Molecular formula
- C13H17N5
- Average molar mass
- 243.31 g/mol
- Monoisotopic mass
- 243.14839556
Names & identifiers
- Preferred name
- Guanidine, 2-cyano-1-cyclohexyl-3-(4-pyridyl)-
- IUPAC
- 1-cyano-2-cyclohexyl-3-pyridin-4-ylguanidine
- English name
- 2-Cyano-1-cyclohexyl-3-(4-pyridyl)guanidine
- Molecular weight
- 0
Names & synonyms
BRN 04183342-Cyano-1-cyclohexyl-3-(4-pyridyl)guanidineGUANIDINE, 2-CYANO-1-CYCLOHEXYL-3-(4-PYRIDYL)-67026-52-2DTXSID30217260RefChem:346960DTXCID30139751CHEMBL86536N-Cyano-N''-cyclohexyl-N'-(pyridin-4-yl)guanidine
Database identifiers
- CAS
67026-52-2- PubChem CID
- 48873
- DTXSID
DTXSID30217260- ChEMBL
CHEMBL86536- Nikkaji
- J78.460E
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 73.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 318
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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