Indeno(1,2-c)pyrazol-4-ol, 1,4-dihydro-3-tert-butyl-4-(3-(dimethylamino)propyl)-1-ethyl-
Basic information
- CAS
68946-21-4- Standard SMILES
CCn1nc(C(C)(C)C)c2c1-c1ccccc1C2(O)CCCN(C)C- InChIKey
UZOJZYCTKHTMHG-UHFFFAOYSA-N- Molecular formula
- C21H31N3O
- Average molar mass
- 341.5 g/mol
- Monoisotopic mass
- 341.24671262
Names & identifiers
- Preferred name
- Indeno(1,2-c)pyrazol-4-ol, 1,4-dihydro-3-tert-butyl-4-(3-(dimethylamino)propyl)-1-ethyl-
- IUPAC
- 3-tert-butyl-4-[3-(dimethylamino)propyl]-1-ethylindeno[2,1-d]pyrazol-4-ol
- English name
- 1,4-Dihydro-3-tert-butyl-4-(3-dimethylaminopropyl)-1-ethylindeno[1,2-c]pyrazol-4-ol
- Molecular weight
- 0
Names & synonyms
68946-21-4BRN 0692701Indeno(1,2-c)pyrazol-4-ol, 1,4-dihydro-3-tert-butyl-4-(3-(dimethylamino)propyl)-1-ethyl-RefChem:3490793-tert-butyl-4-[3-(dimethylamino)propyl]-1-ethyl-1,4-dihydroindeno[1,2-c]pyrazol-4-ol3-(tert-Butyl)-4-(3-(dimethylamino)propyl)-1-ethyl-1,4-dihydroindeno[1,2-c]pyrazol-4-ol3-tert-Butyl-4-(3-(dimethylamino)propyl)-1-ethyl-1,4-dihydroindeno(1,2-c)pyrazol-4-olDTXSID809886751,4-Dihydro-3-tert-butyl-4-(3-dimethylaminopropyl)-1-ethylindeno[1,2-c]pyrazol-4-ol
Database identifiers
- CAS
68946-21-4- PubChem CID
- 216358
- DTXSID
DTXSID80988675- Nikkaji
- J62.635J
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 41.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 461
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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