2-(3-methylphenyl)-3-phenyl-1H-indole

C21H17N — CID 123796416

IUPAC2-(3-methylphenyl)-3-phenyl-1H-indole
SMILESCc1cccc(-c2[nH]c3ccccc3c2-c2ccccc2)c1
InChIInChI=1S/C21H17N/c1-15-8-7-11-17(14-15)21-20(16-9-3-2-4-10-16)18-12-5-6-13-19(18)22-21/h2-14,22H,1H3
InChIKeyAQMVMKUYTLPZSC-UHFFFAOYSA-N
MW283.37 g/mol
LogP5.81
Rot. Bonds2

About 2-(3-methylphenyl)-3-phenyl-1H-indole

2-(3-methylphenyl)-3-phenyl-1H-indole (PubChem CID 123796416) has the molecular formula C21H17N and a molecular weight of 283.37 g/mol. Its IUPAC name is 2-(3-methylphenyl)-3-phenyl-1H-indole.

Molecular Properties

Compound Name2-(3-methylphenyl)-3-phenyl-1H-indole
PubChem CID123796416
Molecular FormulaC21H17N
Molecular Weight283.37 g/mol
Exact Mass283.14
IUPAC Name2-(3-methylphenyl)-3-phenyl-1H-indole
SMILESCc1cccc(-c2[nH]c3ccccc3c2-c2ccccc2)c1
InChIInChI=1S/C21H17N/c1-15-8-7-11-17(14-15)21-20(16-9-3-2-4-10-16)18-12-5-6-13-19(18)22-21/h2-14,22H,1H3
InChIKeyAQMVMKUYTLPZSC-UHFFFAOYSA-N
XLogP5.81
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500283.37
LogP ≤ 55.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

2-(3-methyl-1H-indol-2-yl)-3-phenyl-1H-indole
CID 629515
3-(4-tert-butylphenyl)-2-phenyl-1H-indole
CID 12065981
3-(4-fluoro-3-methylphenyl)-2-phenyl-1H-indole
CID 158433984
4-[2-(4-phenylphenyl)-1H-indol-3-yl]phenol
CID 132917859
3-[2-(3-formylphenyl)-1H-indol-3-yl]benzaldehyde
CID 102572070
4-(2-phenyl-1H-indol-3-yl)benzonitrile
CID 12065987
methane;1-(3-methylphenyl)-2,3,4,5-tetraphenylbenzene
CID 142335654
3,5-dimethyl-2-phenyl-1H-indole;ethane
CID 91536614
4-(4-aminophenyl)-2,3-bis(3-methylphenyl)-5,6-diphenylaniline
CID 22630523
2,3-bis(4-methoxyphenyl)-1H-indole
CID 21129
9H-carbazole;9,10-diphenylanthracene
CID 159841164
ethyl 5-methyl-2-(3-methylphenyl)-4-phenyl-1H-pyrrole-3-carboxylate
CID 102491425

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylphenyl)-3-phenyl-1H-indole?
The IUPAC name of 2-(3-methylphenyl)-3-phenyl-1H-indole (CID 123796416) is 2-(3-methylphenyl)-3-phenyl-1H-indole.
What is the SMILES notation for 2-(3-methylphenyl)-3-phenyl-1H-indole?
The canonical SMILES for 2-(3-methylphenyl)-3-phenyl-1H-indole is Cc1cccc(-c2[nH]c3ccccc3c2-c2ccccc2)c1.
What is the InChIKey of 2-(3-methylphenyl)-3-phenyl-1H-indole?
The InChIKey is AQMVMKUYTLPZSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17N/c1-15-8-7-11-17(14-15)21-20(16-9-3-2-4-10-16)18-12-5-6-13-19(18)22-21/h2-14,22H,1H3.
What are the key properties of 2-(3-methylphenyl)-3-phenyl-1H-indole?
2-(3-methylphenyl)-3-phenyl-1H-indole has a molecular weight of 283.37 g/mol, XLogP of 5.81, 2 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylphenyl)-3-phenyl-1H-indole is sourced from PubChem (CID 123796416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).