Basic information
- CAS
52018-92-5- Standard SMILES
CCC(N)Cc1c(-c2ccc(OC)cc2)[nH]c2ccccc12- InChIKey
BDUPTMIKBIYGCC-UHFFFAOYSA-N- Molecular formula
- C19H22N2O
- Average molar mass
- 294.4 g/mol
- Monoisotopic mass
- 294.17321333
Names & identifiers
- Preferred name
- Indole, 3-(2-aminobutyl)-2-(p-methoxyphenyl)-
- IUPAC
- 1-[2-(4-methoxyphenyl)-1H-indol-3-yl]butan-2-amine
- English name
- 3-(2-Aminobutyl)-2-(p-methoxyphenyl)-1H-indole
- Molecular formula
- C19H22N2O
- Molecular weight
- 294.39
Names & synonyms
3-(2-Aminobutyl)-2-(p-methoxyphenyl)indole52018-92-5INDOLE, 3-(2-AMINOBUTYL)-2-(p-METHOXYPHENYL)-1H-Indole-3-ethanamine, alpha-ethyl-2-(4-methoxyphenyl)-RefChem:3492311H-Indole-3-ethanamine, alpha-ethyl-2-(4-methoxyphenyl)-(9CI)1-[2-(4-methoxyphenyl)-1H-indol-3-yl]butan-2-amineDTXSID40966353DB-2934533-(2-Aminobutyl )-2-(p-methoxyphenyl )-1h-indole3-(2-Aminobutyl)-2-(p-methoxyphenyl)-1H-indole1H-Indole-3-ethanamine, α-ethyl-2-(4-methoxyphenyl)-
Database identifiers
- CAS
52018-92-5- PubChem CID
- 40196
- DTXSID
DTXSID40966353- Nikkaji
- J62.646E
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 51 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 340
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…