Basic information
- CAS
67026-50-0- Standard SMILES
CC(N=C(NC#N)Nc1ccncc1)C1CC1- InChIKey
YVEOIBPXMPCJNQ-UHFFFAOYSA-N- Molecular formula
- C12H15N5
- Average molar mass
- 229.28 g/mol
- Monoisotopic mass
- 229.1327455
Names & identifiers
- Preferred name
- Guanidine, 2-cyano-1-(1-cyclopropylethyl)-3-(4-pyridyl)-
- IUPAC
- 1-cyano-2-(1-cyclopropylethyl)-3-pyridin-4-ylguanidine
- English name
- 2-Cyano-1-(1-cyclopropylethyl)-3-(4-pyridyl)guanidine
- Molecular weight
- 0
Names & synonyms
67026-50-0GUANIDINE, 2-CYANO-1-(1-CYCLOPROPYLETHYL)-3-(4-PYRIDYL)-RefChem:1086251BRN 04080032-Cyano-1-(1-cyclopropylethyl)-3-(4-pyridyl)guanidineCHEMBL86567DTXSID60985889N''-Cyano-N-(1-cyclopropylethyl)-N'-pyridin-4(1H)-ylideneguanidineN''-Cyano-N-(1-cyclopropylethyl)-N'-(pyridin-4(1H)-ylidene)guanidine1-cyano-2-(1-cyclopropylethyl)-3-pyridin-4-ylguanidine
Database identifiers
- CAS
67026-50-0- PubChem CID
- 48871
- DTXSID
DTXSID60985889- ChEMBL
CHEMBL86567- Nikkaji
- J78.463J
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 73.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 319
Chemistry & industry
Suppliers1 total
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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