Basic information
- CAS
72467-44-8- Standard SMILES
Clc1cccc(Cl)c1N(C1=NCCN1)C1CCCCO1- InChIKey
NYQGJEQCYOJBPV-UHFFFAOYSA-N- Molecular formula
- C14H17Cl2N3O
- Average molar mass
- 314.2 g/mol
- Monoisotopic mass
- 313.0748676
Names & identifiers
- Preferred name
- Piclonidine
- IUPAC
- N-(2,6-dichlorophenyl)-N-(oxan-2-yl)-4,5-dihydro-1H-imidazol-2-amine
- English name
- piclonidine
- Molecular formula
- C14H17Cl2N3O
- Molecular weight
- 314.21
Names & synonyms
Piclonidine72467-44-8PiclonidinaPiclonidine [INN]PiclonidinumPiclonidinum [INN-Latin]Piclonidina [INN-Spanish]UNII-R7P4D56J1ZR7P4D56J1ZEINECS 276-672-6LR99853Piclonidinum (INN-Latin)
Show more names
LR 99853N-(2,6-Dichlorophenyl)-N-(tetrahydro-2H-pyran-2-yl)-4,5-dihydro-1H-imidazol-2-amine
Piclonidina (INN-Spanish)(+-)-2-(2,6-Dichloro-N-(tetrahydro-2H-pyran-2-yl)anilino-2-imidazolineN-(2,6-DICHLOROPHENYL)-4,5-DIHYDRO-N-(TETRAHYDRO-2H-PYRAN-2-YL)-1H-IMIDAZOL-2-AMINE1H-IMIDAZOL-2-AMINE, N-(2,6-DICHLOROPHENYL)-4,5-DIHYDRO-N-(TETRAHYDRO-2H-PYRAN-2-YL)-RefChem:174147276-672-6N-(2,6-dichlorophenyl)-N-(oxan-2-yl)-4,5-dihydro-1H-imidazol-2-amineLR-99853
Database identifiers
- CAS
72467-44-8- PubChem CID
- 68914
- DTXSID
DTXSID00868142- ChEMBL
CHEMBL2106921- UNII
- R7P4D56J1Z
- EC Number
- 276-672-6
- Nikkaji
- J22.646G
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 36.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 356
Physicochemical properties
- FDA UNII
- 7 P4D56J1Z · R7P4D56J1Z
Chemistry & industry
Suppliers1 total
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Related reactions
0 records
No reaction records under the current filter.
Compound notes
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