chempirical

1-Methyl-2-phenylindole

C15H13NCAS 3558-24-5207.28 g/mol

Open in Covalent MOL file
N

Properties

Molecular formula
C15H13N
Molar mass
207.28 g/mol
Exact mass
207.1048 Da
Melting point
100–101 °C
logP
3.85Crippen estimate
Polar surface area
4.9 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
1

Identifiers

CAS number
3558-24-5
SMILES
Cn1c(-c2ccccc2)cc2ccccc21
InChIKey
SFWZZSXCWQTORH-UHFFFAOYSA-N
InChI
InChI=1S/C15H13N/c1-16-14-10-6-5-9-13(14)11-15(16)12-7-3-2-4-8-12/h2-11H,1H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

7 names
  • 1H-Indole, 1-methyl-2-phenyl-
  • Indole, 1-methyl-2-phenyl-
  • 1-Methyl-2-phenyl-1H-indole
  • 2-Phenyl-N-methylindole
  • N-Methyl-2-phenylindole
  • NSC 63793
  • 2-Phenyl-1-methylindole

Work with 1-Methyl-2-phenylindole

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1-Ethyl-2-phenyl-1H-indole13228-39-256 % similar 1,2-Dimethylindole875-79-655 % similar 1-Methyl-1H-indole-2-carboxylic acid16136-58-646 % similar 1-Methyl-2(1H)-quinolinone606-43-944 % similar N-Methylcarbazole1484-12-440 % similar Difenzoquat49866-87-738 % similar 1-Methyl-2-phenyl-1H-indole-3-carboxaldehyde1757-72-837 % similar 1-Methylindole603-76-936 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

4-Benzylphenylacetonitrile101096-72-4 β-Phenylbenzenepropanenitrile2286-54-6 1-Benzylindole3377-71-7 α-Methyl-α-phenylbenzeneacetonitrile5558-67-8 4-Ethyl-4′-cyanobiphenyl58743-75-2

Elsewhere

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