Basic information
- Standard SMILES
Cl.N=C(NC1CCCCC1)NC12CC3CC(CC(C3)C1)C2- InChIKey
JWASQEHLCNCBPD-UHFFFAOYSA-N- Molecular formula
- C17H30ClN3
- Average molar mass
- 311.9 g/mol
- Monoisotopic mass
- 311.2128257
Names & identifiers
- Preferred name
- Adamantan-1-yl-N'-cyclohexylguanidine HCl
- IUPAC
- 1-(1-adamantyl)-2-cyclohexylguanidine;hydrochloride
Names & synonyms
CHEMBL543597SCHEMBL6158207SCHEMBL6158212JWASQEHLCNCBPD-UHFFFAOYSA-NAdamantan-1-yl-N'-cyclohexylguanidine HClN-Adamantan-1-yl-N'-cyclohexylguanidine-HCl
Database identifiers
- PubChem CID
- 14771739
Properties
Computed structural properties
- Topological polar surface area
- 50.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 354
Related reactions
5 records
Compound notes
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