3-(2,3-dihydroindol-1-yl)-1,4-diphenylpyrrole-2,5-dione

C24H18N2O2 — CID 110561108

IUPAC3-(2,3-dihydroindol-1-yl)-1,4-diphenylpyrrole-2,5-dione
SMILESO=C1C(c2ccccc2)=C(N2CCc3ccccc32)C(=O)N1c1ccccc1
InChIInChI=1S/C24H18N2O2/c27-23-21(18-10-3-1-4-11-18)22(24(28)26(23)19-12-5-2-6-13-19)25-16-15-17-9-7-8-14-20(17)25/h1-14H,15-16H2
InChIKeyXGOMDASXCPETOG-UHFFFAOYSA-N
MW366.42 g/mol
LogP4.03
Rot. Bonds3

About 3-(2,3-dihydroindol-1-yl)-1,4-diphenylpyrrole-2,5-dione

3-(2,3-dihydroindol-1-yl)-1,4-diphenylpyrrole-2,5-dione (PubChem CID 110561108) has the molecular formula C24H18N2O2 and a molecular weight of 366.42 g/mol. Its IUPAC name is 3-(2,3-dihydroindol-1-yl)-1,4-diphenylpyrrole-2,5-dione.

Molecular Properties

Compound Name3-(2,3-dihydroindol-1-yl)-1,4-diphenylpyrrole-2,5-dione
PubChem CID110561108
Molecular FormulaC24H18N2O2
Molecular Weight366.42 g/mol
Exact Mass366.14
IUPAC Name3-(2,3-dihydroindol-1-yl)-1,4-diphenylpyrrole-2,5-dione
SMILESO=C1C(c2ccccc2)=C(N2CCc3ccccc32)C(=O)N1c1ccccc1
InChIInChI=1S/C24H18N2O2/c27-23-21(18-10-3-1-4-11-18)22(24(28)26(23)19-12-5-2-6-13-19)25-16-15-17-9-7-8-14-20(17)25/h1-14H,15-16H2
InChIKeyXGOMDASXCPETOG-UHFFFAOYSA-N
XLogP4.03
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.42
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Related Compounds

3-(2,3-dihydroindol-1-yl)-1-[4-(dimethylamino)phenyl]-4-phenylpyrrole-2,5-dione
CID 110558734
3-(2,3-dihydroindol-1-yl)-1-(4-methoxyphenyl)-4-phenylpyrrole-2,5-dione
CID 110560752
1-(3,4-difluorophenyl)-3-(2,3-dihydroindol-1-yl)-4-phenylpyrrole-2,5-dione
CID 110562035
3-(3,4-dihydro-2H-quinolin-1-yl)-4-(4-methylphenyl)-1-phenylpyrrole-2,5-dione
CID 110573925
3-(2,3-dihydroindol-1-yl)-4-[4-(2-methylpropoxy)phenyl]-1-phenylpyrrole-2,5-dione
CID 110551774
3-(2,3-dihydroindol-1-yl)-1-(3,5-dimethylphenyl)-4-(4-methylphenyl)pyrrole-2,5-dione
CID 110573345
3-(3,4-dihydro-2H-quinolin-1-yl)-1-(4-ethylphenyl)-4-phenylpyrrole-2,5-dione
CID 110560853
1-(3-bromophenyl)-3-(2,3-dihydroindol-1-yl)-4-(4-methylphenyl)pyrrole-2,5-dione
CID 110573315
propyl 4-[3-(2,3-dihydroindol-1-yl)-2,5-dioxo-4-phenylpyrrol-1-yl]benzoate
CID 110561016
3-(2,3-dihydroindol-1-yl)-1-(3,5-dimethoxyphenyl)-4-(4-methoxyphenyl)pyrrole-2,5-dione
CID 110555634
3-(2,3-dihydroindol-1-yl)-4-(2,4-dimethylphenyl)-1-phenylpyrrole-2,5-dione
CID 110579822
1-(3,5-dichlorophenyl)-3-(2,3-dihydroindol-1-yl)-4-(4-fluorophenyl)pyrrole-2,5-dione
CID 110544782

Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dihydroindol-1-yl)-1,4-diphenylpyrrole-2,5-dione?
The IUPAC name of 3-(2,3-dihydroindol-1-yl)-1,4-diphenylpyrrole-2,5-dione (CID 110561108) is 3-(2,3-dihydroindol-1-yl)-1,4-diphenylpyrrole-2,5-dione.
What is the SMILES notation for 3-(2,3-dihydroindol-1-yl)-1,4-diphenylpyrrole-2,5-dione?
The canonical SMILES for 3-(2,3-dihydroindol-1-yl)-1,4-diphenylpyrrole-2,5-dione is O=C1C(c2ccccc2)=C(N2CCc3ccccc32)C(=O)N1c1ccccc1.
What is the InChIKey of 3-(2,3-dihydroindol-1-yl)-1,4-diphenylpyrrole-2,5-dione?
The InChIKey is XGOMDASXCPETOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18N2O2/c27-23-21(18-10-3-1-4-11-18)22(24(28)26(23)19-12-5-2-6-13-19)25-16-15-17-9-7-8-14-20(17)25/h1-14H,15-16H2.
What are the key properties of 3-(2,3-dihydroindol-1-yl)-1,4-diphenylpyrrole-2,5-dione?
3-(2,3-dihydroindol-1-yl)-1,4-diphenylpyrrole-2,5-dione has a molecular weight of 366.42 g/mol, XLogP of 4.03, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dihydroindol-1-yl)-1,4-diphenylpyrrole-2,5-dione is sourced from PubChem (CID 110561108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).