Basic information
- CAS
145296-53-3- Standard SMILES
Cc1c[nH]c2cccc(OCC(O)CNC(C)(C)C)c12.Cl- InChIKey
RYWYJFFZUWUUIY-UHFFFAOYSA-N- Molecular formula
- C16H25ClN2O2
- Average molar mass
- 312.83 g/mol
- Monoisotopic mass
- 312.1604557
Names & identifiers
- Preferred name
- 2-Propanol, 1-((1,1-dimethylethyl)amino)-3-((3-methyl-1H-indol-4-yl)oxy)-, monohydrochloride
- IUPAC
- 1-(tert-butylamino)-3-[(3-methyl-1H-indol-4-yl)oxy]propan-2-ol;hydrochloride
Names & synonyms
145296-53-31-((1,1-Dimethylethyl)amino)-3-((3-methyl-1H-indol-4-yl)oxy)-2-propanol monohydrochloride2-Propanol, 1-((1,1-dimethylethyl)amino)-3-((3-methyl-1H-indol-4-yl)oxy)-, monohydrochlorideRefChem:265576MLS0000388701-(tert-butylamino)-3-[(3-methyl-1H-indol-4-yl)oxy]propan-2-ol;hydrochloride1-(tert-butylamino)-3-((3-methyl-1H-indol-4-yl)oxy)propan-2-ol hydrochlorideSMR000036387MLS002583702CHEMBL1589313DTXSID70932561AKOS030505847
Show more names
1-(tert-Butylamino)-3-[(3-methyl-1H-indol-4-yl)oxy]propan-2-ol--hydrogen chloride (1/1)
Database identifiers
- CAS
145296-53-3- PubChem CID
- 3072986
- DTXSID
DTXSID70932561- ChEMBL
CHEMBL1589313
Properties
Computed structural properties
- Topological polar surface area
- 57.3 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 303
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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