Basic information
- CAS
170493-80-8- Standard SMILES
Cc1ccc2c(c1)-c1c(ccn1C[C@H](C)N)C2- InChIKey
SODYJZFWKMYTAY-NSHDSACASA-N- Molecular formula
- C15H18N2
- Average molar mass
- 226.32 g/mol
- Monoisotopic mass
- 226.14699858
Names & identifiers
- Preferred name
- Indeno(1,2-b)pyrrole-1(4H)-ethanamine, alpha,7-dimethyl-, (S)-
- IUPAC
- (2S)-1-(7-methyl-4H-indeno[1,2-b]pyrrol-1-yl)propan-2-amine
Names & synonyms
RO 60-0313170493-80-8Indeno(1,2-b)pyrrole-1(4H)-ethanamine, alpha,7-dimethyl-, (S)-SCHEMBL8596506DTXSID30168869(2S)-1-(7-Methylindeno[1,2-b]pyrrol-1(4H)-yl)propan-2-amineIndeno(1,2-b)pyrrole-1(4H)-ethanamine, alpha,7-dimethyl-, (alphaS)-
Database identifiers
- CAS
170493-80-8- PubChem CID
- 3045237
- DTXSID
DTXSID30168869- Nikkaji
- J973.442B
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 31 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 278
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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