Basic information
- CAS
89292-95-5- Standard SMILES
Nc1nc(N2CCN(CC3CCCCC3)CC2)n[nH]1- InChIKey
ZMCSEXZPLSVZEF-UHFFFAOYSA-N- Molecular formula
- C13H24N6
- Average molar mass
- 264.37 g/mol
- Monoisotopic mass
- 264.20624479
Names & identifiers
- Preferred name
- 3-[4-(cyclohexylmethyl)piperazin-1-yl]-1H-1,2,4-triazol-5-amine
- IUPAC
- 3-[4-(cyclohexylmethyl)piperazin-1-yl]-1H-1,2,4-triazol-5-amine
Names & synonyms
89292-95-53-[4-(cyclohexylmethyl)piperazin-1-yl]-1H-1,2,4-triazol-5-amineCHEMBL154133SCHEMBL11197489DTXSID90533251
Database identifiers
- CAS
89292-95-5- PubChem CID
- 13267635
- DTXSID
DTXSID90533251- ChEMBL
CHEMBL154133
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 74.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 272
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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