1-(3-methylphenyl)-2-phenylindole

C21H17N — CID 101372494

IUPAC1-(3-methylphenyl)-2-phenylindole
SMILESCc1cccc(-n2c(-c3ccccc3)cc3ccccc32)c1
InChIInChI=1S/C21H17N/c1-16-8-7-12-19(14-16)22-20-13-6-5-11-18(20)15-21(22)17-9-3-2-4-10-17/h2-15H,1H3
InChIKeyARRSGBUTYSGQSO-UHFFFAOYSA-N
MW283.37 g/mol
LogP5.61
Rot. Bonds2

About 1-(3-methylphenyl)-2-phenylindole

1-(3-methylphenyl)-2-phenylindole (PubChem CID 101372494) has the molecular formula C21H17N and a molecular weight of 283.37 g/mol. Its IUPAC name is 1-(3-methylphenyl)-2-phenylindole.

Molecular Properties

Compound Name1-(3-methylphenyl)-2-phenylindole
PubChem CID101372494
Molecular FormulaC21H17N
Molecular Weight283.37 g/mol
Exact Mass283.14
IUPAC Name1-(3-methylphenyl)-2-phenylindole
SMILESCc1cccc(-n2c(-c3ccccc3)cc3ccccc32)c1
InChIInChI=1S/C21H17N/c1-16-8-7-12-19(14-16)22-20-13-6-5-11-18(20)15-21(22)17-9-3-2-4-10-17/h2-15H,1H3
InChIKeyARRSGBUTYSGQSO-UHFFFAOYSA-N
XLogP5.61
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 ≤ 55.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1,2-bis(4-methylphenyl)indole
CID 151814608
9-(3-methylphenyl)-3,6-diphenylcarbazole;9-(3-methylphenyl)-3-phenylcarbazole
CID 162048953
2-phenyl-1-pyridin-3-ylindole
CID 59214542
ethane;9-(3-methylphenyl)carbazole
CID 143904684
2-methyl-1-(3-methylphenyl)-5-phenylpyrrole-3-carbaldehyde
CID 4767653
N,N-diphenyl-4-(1-phenylindol-2-yl)aniline
CID 59993805
9-[4-[1-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]indol-2-yl]phenyl]carbazole
CID 145105553
9-(3-methylphenyl)-14-[3-(4-phenylphenyl)phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 126501118
1-[3-(4-methylphenyl)naphthalen-1-yl]-2-phenylindole
CID 163207259
N,N-dimethyl-4-(2-phenylindol-1-yl)cyclodeca-1,3,5,7,9-pentaene-1-carboxamide
CID 143214514
N-phenyl-N-[4-(1-phenylindol-2-yl)phenyl]naphthalen-1-amine
CID 145013973
N-phenyl-N-[4-(2-phenylindol-1-yl)phenyl]-4-[4-(N-[4-(2-phenylindol-1-yl)phenyl]anilino)phenyl]aniline
CID 144768904

Frequently Asked Questions

What is the IUPAC name of 1-(3-methylphenyl)-2-phenylindole?
The IUPAC name of 1-(3-methylphenyl)-2-phenylindole (CID 101372494) is 1-(3-methylphenyl)-2-phenylindole.
What is the SMILES notation for 1-(3-methylphenyl)-2-phenylindole?
The canonical SMILES for 1-(3-methylphenyl)-2-phenylindole is Cc1cccc(-n2c(-c3ccccc3)cc3ccccc32)c1.
What is the InChIKey of 1-(3-methylphenyl)-2-phenylindole?
The InChIKey is ARRSGBUTYSGQSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17N/c1-16-8-7-12-19(14-16)22-20-13-6-5-11-18(20)15-21(22)17-9-3-2-4-10-17/h2-15H,1H3.
What are the key properties of 1-(3-methylphenyl)-2-phenylindole?
1-(3-methylphenyl)-2-phenylindole has a molecular weight of 283.37 g/mol, XLogP of 5.61, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methylphenyl)-2-phenylindole is sourced from PubChem (CID 101372494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).