5,6-diphenyl-1H-indole

C20H15N — CID 174399063

IUPAC5,6-diphenyl-1H-indole
SMILESc1ccc(-c2cc3cc[nH]c3cc2-c2ccccc2)cc1
InChIInChI=1S/C20H15N/c1-3-7-15(8-4-1)18-13-17-11-12-21-20(17)14-19(18)16-9-5-2-6-10-16/h1-14,21H
InChIKeyYVCKUBIUUOMOGQ-UHFFFAOYSA-N
MW269.35 g/mol
LogP5.50
Rot. Bonds2

About 5,6-diphenyl-1H-indole

5,6-diphenyl-1H-indole (PubChem CID 174399063) has the molecular formula C20H15N and a molecular weight of 269.35 g/mol. Its IUPAC name is 5,6-diphenyl-1H-indole.

Molecular Properties

Compound Name5,6-diphenyl-1H-indole
PubChem CID174399063
Molecular FormulaC20H15N
Molecular Weight269.35 g/mol
Exact Mass269.12
IUPAC Name5,6-diphenyl-1H-indole
SMILESc1ccc(-c2cc3cc[nH]c3cc2-c2ccccc2)cc1
InChIInChI=1S/C20H15N/c1-3-7-15(8-4-1)18-13-17-11-12-21-20(17)14-19(18)16-9-5-2-6-10-16/h1-14,21H
InChIKeyYVCKUBIUUOMOGQ-UHFFFAOYSA-N
XLogP5.50
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500269.35
LogP ≤ 55.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

2-phenyl-1,7-dihydropyrrolo[3,2-f]indole
CID 13250404
5-[2-(1H-indol-5-yl)phenyl]-1H-indole
CID 102414263
3-phenyl-2-(3-phenyl-1H-pyrrol-2-yl)-1H-pyrrole
CID 102186152
3,9-dihydropyrrolo[3,2-b]carbazole
CID 57114710
5-phenyl-1H-quinolin-4-one
CID 155929320
5-[2-[(2-phenylphenyl)methoxy]phenyl]-1H-indole
CID 141077944
6-naphthalen-1-yl-1H-indole
CID 19779684
4-(1H-indol-5-yl)-N-phenylaniline
CID 134533945
1H-indole;dihydrochloride
CID 18796541
2-methyl-3-phenyl-1H-pyrrole
CID 10419429
2-(1H-indol-5-yl)benzonitrile
CID 21468934
5-phenylsulfanyl-1H-indol-6-amine
CID 57126172

Frequently Asked Questions

What is the IUPAC name of 5,6-diphenyl-1H-indole?
The IUPAC name of 5,6-diphenyl-1H-indole (CID 174399063) is 5,6-diphenyl-1H-indole.
What is the SMILES notation for 5,6-diphenyl-1H-indole?
The canonical SMILES for 5,6-diphenyl-1H-indole is c1ccc(-c2cc3cc[nH]c3cc2-c2ccccc2)cc1.
What is the InChIKey of 5,6-diphenyl-1H-indole?
The InChIKey is YVCKUBIUUOMOGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N/c1-3-7-15(8-4-1)18-13-17-11-12-21-20(17)14-19(18)16-9-5-2-6-10-16/h1-14,21H.
What are the key properties of 5,6-diphenyl-1H-indole?
5,6-diphenyl-1H-indole has a molecular weight of 269.35 g/mol, XLogP of 5.50, 2 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-diphenyl-1H-indole is sourced from PubChem (CID 174399063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).