2-((2-Hydroxy-3-(1H-indol-1-yl)propyl)amino)phenol
Basic information
- CAS
856437-82-6- Standard SMILES
Oc1ccccc1NCC(O)Cn1ccc2ccccc21- InChIKey
XYHIQIZXHBQQCU-UHFFFAOYSA-N- Molecular formula
- C17H18N2O2
- Average molar mass
- 282.34 g/mol
- Monoisotopic mass
- 282.13682782
Names & identifiers
- Preferred name
- 2-((2-Hydroxy-3-(1H-indol-1-yl)propyl)amino)phenol
- IUPAC
- 2-[(2-hydroxy-3-indol-1-ylpropyl)amino]phenol
- English name
- 2-(2-Hydroxy-3-indol-1-yl-propylamino)-phenol
- Molecular formula
- C17H18N2O2
- Molecular weight
- 282.34
Names & synonyms
856437-82-62-((2-Hydroxy-3-(1H-indol-1-yl)propyl)amino)phenol2-(2-Hydroxy-3-indol-1-yl-propylamino)-phenol2-{[2-hydroxy-3-(1H-indol-1-yl)propyl]amino}phenolMLS000027957SMR000015304cid_653757CHEMBL1624172BDBM50003DTXSID401207558SBB012226AKOS000302739
Show more names
TIMTEC-BB SBB012226
AKOS0243037523-[(2-hydroxyphenyl)amino]-1-indolylpropan-2-ol2-[(2-hydroxy-3-indol-1-yl-propyl)amino]phenol;oxalic acid2-[[2-hydroxy-3-(1-indolyl)propyl]amino]phenol;oxalic acidI+/--[[(2-Hydroxyphenyl)amino]methyl]-1H-indole-1-ethanolethanedioic acid;2-[(3-indol-1-yl-2-oxidanyl-propyl)amino]phenol
Database identifiers
- CAS
856437-82-6- PubChem CID
- 653758
- DTXSID
DTXSID401207558- ChEMBL
CHEMBL1624172
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 57.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 326
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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