Basic information
- CAS
3414-75-3- Standard SMILES
Nc1ccc2[nH]cc(CN3CCCC3)c2c1- InChIKey
XINXCFLBEJQVSW-UHFFFAOYSA-N- Molecular formula
- C13H17N3
- Average molar mass
- 215.29 g/mol
- Monoisotopic mass
- 215.14224756
Names & identifiers
- Preferred name
- 3-(1-Pyrrolidinylmethyl)-1H-indol-5-amine
- IUPAC
- 3-(pyrrolidin-1-ylmethyl)-1H-indol-5-amine
Names & synonyms
3414-75-3INDOLE, 5-AMINO-3-(1-PYRROLIDINYLMETHYL)-3-(1-Pyrrolidinylmethyl)-1H-indol-5-amineDTXSID90187738RefChem:1066410DTXCID50110229BRN 04011735-Amino-3-(pyrrolidinomethyl) indole3-[(Pyrrolidin-1-yl)methyl]-1H-indol-5-amine
Database identifiers
- CAS
3414-75-3- PubChem CID
- 18892
- DTXSID
DTXSID90187738
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 45.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 237
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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