Basic information
- Standard SMILES
Cc1cc2ccccc2n1Cc1ccccc1- InChIKey
DPNOTFHCABPNQH-UHFFFAOYSA-N- Molecular formula
- C16H15N
- Average molar mass
- 221.3 g/mol
- Monoisotopic mass
- 221.12044948
Names & identifiers
- Preferred name
- 1-Benzyl-2-methylindole
- IUPAC
- 1-benzyl-2-methylindole
Names & synonyms
1-benzyl-2-methylindole17901-58-5DTXSID40391287RefChem:227961DTXCID903421481-Benzyl-2-methyl-1H-indole1H-Indole, 2-methyl-1-(phenylmethyl)-1-benzyl-2-methyl-indoleN-benzyl-2-methylindoleSCHEMBL4057306SCHEMBL6821030SCHEMBL10399302
Show more names
SCHEMBL30049411DPNOTFHCABPNQH-UHFFFAOYSA-NALBB-035653MFCD04343149AKOS005208581HS-7690CS-0282096EN300-234722
Database identifiers
- CAS
17901-58-5- PubChem CID
- 3307151
- DTXSID
DTXSID40391287- Nikkaji
- J614.463B
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 4.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 244
Related reactions
4 records
Linked notes
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