1-methyl-2,3-diphenylindole

C21H17N — CID 11426096

IUPAC1-methyl-2,3-diphenylindole
SMILESCn1c(-c2ccccc2)c(-c2ccccc2)c2ccccc21
InChIInChI=1S/C21H17N/c1-22-19-15-9-8-14-18(19)20(16-10-4-2-5-11-16)21(22)17-12-6-3-7-13-17/h2-15H,1H3
InChIKeyGLZYQDUARIJZFU-UHFFFAOYSA-N
MW283.37 g/mol
LogP5.51
Rot. Bonds2

About 1-methyl-2,3-diphenylindole

1-methyl-2,3-diphenylindole (PubChem CID 11426096) has the molecular formula C21H17N and a molecular weight of 283.37 g/mol. Its IUPAC name is 1-methyl-2,3-diphenylindole.

Molecular Properties

Compound Name1-methyl-2,3-diphenylindole
PubChem CID11426096
Molecular FormulaC21H17N
Molecular Weight283.37 g/mol
Exact Mass283.14
IUPAC Name1-methyl-2,3-diphenylindole
SMILESCn1c(-c2ccccc2)c(-c2ccccc2)c2ccccc21
InChIInChI=1S/C21H17N/c1-22-19-15-9-8-14-18(19)20(16-10-4-2-5-11-16)21(22)17-12-6-3-7-13-17/h2-15H,1H3
InChIKeyGLZYQDUARIJZFU-UHFFFAOYSA-N
XLogP5.51
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500283.37
LogP ≤ 55.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-2,3-diphenylindole?
The IUPAC name of 1-methyl-2,3-diphenylindole (CID 11426096) is 1-methyl-2,3-diphenylindole.
What is the SMILES notation for 1-methyl-2,3-diphenylindole?
The canonical SMILES for 1-methyl-2,3-diphenylindole is Cn1c(-c2ccccc2)c(-c2ccccc2)c2ccccc21.
What is the InChIKey of 1-methyl-2,3-diphenylindole?
The InChIKey is GLZYQDUARIJZFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17N/c1-22-19-15-9-8-14-18(19)20(16-10-4-2-5-11-16)21(22)17-12-6-3-7-13-17/h2-15H,1H3.
What are the key properties of 1-methyl-2,3-diphenylindole?
1-methyl-2,3-diphenylindole has a molecular weight of 283.37 g/mol, XLogP of 5.51, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2,3-diphenylindole is sourced from PubChem (CID 11426096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).