Basic information
- CAS
60560-43-2- Standard SMILES
CCC(C)(C)N=C(NC#N)Nc1c(C)cc(C)nc1C- InChIKey
NZUWSPDEXXXPFP-UHFFFAOYSA-N- Molecular formula
- C15H23N5
- Average molar mass
- 273.38 g/mol
- Monoisotopic mass
- 273.19534575
Names & identifiers
- Preferred name
- Guanidine, 2-cyano-1-(tert-pentyl)-3-(2,4,6-trimethyl-3-pyridyl)-
- IUPAC
- 1-cyano-2-(2-methylbutan-2-yl)-3-(2,4,6-trimethyl-3-pyridinyl)guanidine
- English name
- 2-Cyano-1-(tert-pentyl)-3-(2,4,6-trimethyl-3-pyridyl)guanidine
- Molecular formula
- C15H23N5
- Molecular weight
- 273.38
Names & synonyms
60560-43-2BRN 04233712-Cyano-1-(tert-pentyl)-3-(2,4,6-trimethyl-3-pyridyl)guanidineGUANIDINE, 2-CYANO-1-(tert-PENTYL)-3-(2,4,6-TRIMETHYL-3-PYRIDYL)-DTXSID30209362RefChem:346958DTXCID50131853CHEMBL442976DB-313878N-Cyano-N''-(2-methylbutan-2-yl)-N'-(2,4,6-trimethylpyridin-3-yl)guanidineGuanidine, N-cyano-N'-(1,1-dimethylpropyl)-N''-(2,4,6-trimethyl-3-pyridinyl)-
Database identifiers
- CAS
60560-43-2- PubChem CID
- 43357
- DTXSID
DTXSID30209362- ChEMBL
CHEMBL442976- Nikkaji
- J78.479F
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 73.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 392
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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