2,3-bis(4-methoxyphenyl)-1H-indole

C22H19NO2 — CID 21129

IUPAC2,3-bis(4-methoxyphenyl)-1H-indole
SMILESCOc1ccc(-c2[nH]c3ccccc3c2-c2ccc(OC)cc2)cc1
InChIInChI=1S/C22H19NO2/c1-24-17-11-7-15(8-12-17)21-19-5-3-4-6-20(19)23-22(21)16-9-13-18(25-2)14-10-16/h3-14,23H,1-2H3
InChIKeySRETXDDCKMOQNE-UHFFFAOYSA-N
MW329.40 g/mol
LogP5.52
Rot. Bonds4

About 2,3-bis(4-methoxyphenyl)-1H-indole

2,3-bis(4-methoxyphenyl)-1H-indole (PubChem CID 21129) has the molecular formula C22H19NO2 and a molecular weight of 329.40 g/mol. Its IUPAC name is 2,3-bis(4-methoxyphenyl)-1H-indole.

Molecular Properties

Compound Name2,3-bis(4-methoxyphenyl)-1H-indole
PubChem CID21129
Molecular FormulaC22H19NO2
Molecular Weight329.40 g/mol
Exact Mass329.14
IUPAC Name2,3-bis(4-methoxyphenyl)-1H-indole
SMILESCOc1ccc(-c2[nH]c3ccccc3c2-c2ccc(OC)cc2)cc1
InChIInChI=1S/C22H19NO2/c1-24-17-11-7-15(8-12-17)21-19-5-3-4-6-20(19)23-22(21)16-9-13-18(25-2)14-10-16/h3-14,23H,1-2H3
InChIKeySRETXDDCKMOQNE-UHFFFAOYSA-N
XLogP5.52
TPSA34.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500329.40
LogP ≤ 55.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-chlorophenyl)-3-(4-methoxyphenyl)-1H-indole
CID 71517931
methyl 4-[2-(4-methoxyphenyl)-1H-indol-3-yl]benzoate
CID 71517932
2-[2-(4-methoxyphenyl)-1H-indol-3-yl]-1H-benzimidazole
CID 2437616
2-(4-methoxyphenyl)-5-(2-phenyl-1H-indol-3-yl)-1,3,4-oxadiazole
CID 136746093
3-chloro-2-(4-methoxyphenyl)-1H-quinolin-4-one
CID 70694151
2-phenyl-3-(4-phenylmethoxyphenyl)-1H-indole
CID 139885625
3-(4-tert-butylphenyl)-2-phenyl-1H-indole
CID 12065981
methyl 4-[2-(4-methylphenyl)-1H-indol-3-yl]benzoate
CID 15528443
1-[4-(4-methoxyphenyl)phenyl]-2,4,6-triphenyl-3,5-bis(4-phenylphenyl)benzene
CID 138981847
4-[2-(4-phenylphenyl)-1H-indol-3-yl]phenol
CID 132917859
N-ethyl-2-[2-(4-methoxyphenyl)-1H-indol-3-yl]-N-methylethanamine
CID 59921071
4-(4-methoxyphenyl)-1,2-diphenyl-9H-carbazole
CID 102141749

Frequently Asked Questions

What is the IUPAC name of 2,3-bis(4-methoxyphenyl)-1H-indole?
The IUPAC name of 2,3-bis(4-methoxyphenyl)-1H-indole (CID 21129) is 2,3-bis(4-methoxyphenyl)-1H-indole.
What is the SMILES notation for 2,3-bis(4-methoxyphenyl)-1H-indole?
The canonical SMILES for 2,3-bis(4-methoxyphenyl)-1H-indole is COc1ccc(-c2[nH]c3ccccc3c2-c2ccc(OC)cc2)cc1.
What is the InChIKey of 2,3-bis(4-methoxyphenyl)-1H-indole?
The InChIKey is SRETXDDCKMOQNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19NO2/c1-24-17-11-7-15(8-12-17)21-19-5-3-4-6-20(19)23-22(21)16-9-13-18(25-2)14-10-16/h3-14,23H,1-2H3.
What are the key properties of 2,3-bis(4-methoxyphenyl)-1H-indole?
2,3-bis(4-methoxyphenyl)-1H-indole has a molecular weight of 329.40 g/mol, XLogP of 5.52, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-bis(4-methoxyphenyl)-1H-indole is sourced from PubChem (CID 21129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).