3-(2,3-dihydroindol-1-yl)-1-(3-methoxyphenyl)pyrrolidine-2,5-dione

C19H18N2O3 — CID 2931733

IUPAC3-(2,3-dihydroindol-1-yl)-1-(3-methoxyphenyl)pyrrolidine-2,5-dione
SMILESCOc1cccc(N2C(=O)CC(N3CCc4ccccc43)C2=O)c1
InChIInChI=1S/C19H18N2O3/c1-24-15-7-4-6-14(11-15)21-18(22)12-17(19(21)23)20-10-9-13-5-2-3-8-16(13)20/h2-8,11,17H,9-10,12H2,1H3
InChIKeyYTCVCFKBRWLTLX-UHFFFAOYSA-N
MW322.36 g/mol
LogP2.39
Rot. Bonds3

About 3-(2,3-dihydroindol-1-yl)-1-(3-methoxyphenyl)pyrrolidine-2,5-dione

3-(2,3-dihydroindol-1-yl)-1-(3-methoxyphenyl)pyrrolidine-2,5-dione (PubChem CID 2931733) has the molecular formula C19H18N2O3 and a molecular weight of 322.36 g/mol. Its IUPAC name is 3-(2,3-dihydroindol-1-yl)-1-(3-methoxyphenyl)pyrrolidine-2,5-dione.

Molecular Properties

Compound Name3-(2,3-dihydroindol-1-yl)-1-(3-methoxyphenyl)pyrrolidine-2,5-dione
PubChem CID2931733
Molecular FormulaC19H18N2O3
Molecular Weight322.36 g/mol
Exact Mass322.13
IUPAC Name3-(2,3-dihydroindol-1-yl)-1-(3-methoxyphenyl)pyrrolidine-2,5-dione
SMILESCOc1cccc(N2C(=O)CC(N3CCc4ccccc43)C2=O)c1
InChIInChI=1S/C19H18N2O3/c1-24-15-7-4-6-14(11-15)21-18(22)12-17(19(21)23)20-10-9-13-5-2-3-8-16(13)20/h2-8,11,17H,9-10,12H2,1H3
InChIKeyYTCVCFKBRWLTLX-UHFFFAOYSA-N
XLogP2.39
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.36
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[(S)-1-(2,3-Dihydro-benzofuran-4-yl)-pyrrolidin-3-yl]-butyramide
CID 44358146
1-Ethyl-3-[4-(3-methoxyphenyl)piperazin-1-yl]pyrrolidine-2,5-dione
CID 2950914
3-[Benzyl(methyl)amino]-1-(4-ethoxyphenyl)pyrrolidine-2,5-dione
CID 2839652
3-(2,3-dihydro-1H-indol-1-yl)-1-(2-methoxyphenyl)pyrrolidine-2,5-dione
CID 2919102
3-[4-[4-(3-Methoxyphenyl)piperazin-1-yl]butyl]-1,3-dihydroindol-2-one
CID 11545363
N-[(R)-1-(2,3-Dihydro-benzofuran-4-yl)-pyrrolidin-3-yl]-butyramide
CID 44357899
1-(6-methoxy-2,3-dihydroindol-1-yl)-2-[(3R)-3-methylpiperazin-1-yl]ethanone
CID 90254453
3-(3,4-dihydro-2(1H)-isoquinolinyl)-1-(3-methoxyphenyl)-2,5-pyrrolidinedione
CID 3695414
2-[2-(7-methoxy-2,2,4-trimethylquinolin-1(2H)-yl)-2-oxoethyl]hexahydro-1H-isoindole-1,3(2H)-dione
CID 2913780
N-(2,6-dimethylphenyl)-1-(3-methoxyphenyl)-5-oxopyrrolidine-3-carboxamide
CID 2964345
3-(1,3-Benzodioxol-5-ylamino)-1-(2-methylphenyl)-2,5-pyrrolidinedione
CID 3584205
1-Benzyl-3-(4-(4-methoxyphenyl)piperazin-1-yl)pyrrolidine-2,5-dione
CID 4364255

Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dihydroindol-1-yl)-1-(3-methoxyphenyl)pyrrolidine-2,5-dione?
The IUPAC name of 3-(2,3-dihydroindol-1-yl)-1-(3-methoxyphenyl)pyrrolidine-2,5-dione (CID 2931733) is 3-(2,3-dihydroindol-1-yl)-1-(3-methoxyphenyl)pyrrolidine-2,5-dione.
What is the SMILES notation for 3-(2,3-dihydroindol-1-yl)-1-(3-methoxyphenyl)pyrrolidine-2,5-dione?
The canonical SMILES for 3-(2,3-dihydroindol-1-yl)-1-(3-methoxyphenyl)pyrrolidine-2,5-dione is COc1cccc(N2C(=O)CC(N3CCc4ccccc43)C2=O)c1.
What is the InChIKey of 3-(2,3-dihydroindol-1-yl)-1-(3-methoxyphenyl)pyrrolidine-2,5-dione?
The InChIKey is YTCVCFKBRWLTLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O3/c1-24-15-7-4-6-14(11-15)21-18(22)12-17(19(21)23)20-10-9-13-5-2-3-8-16(13)20/h2-8,11,17H,9-10,12H2,1H3.
What are the key properties of 3-(2,3-dihydroindol-1-yl)-1-(3-methoxyphenyl)pyrrolidine-2,5-dione?
3-(2,3-dihydroindol-1-yl)-1-(3-methoxyphenyl)pyrrolidine-2,5-dione has a molecular weight of 322.36 g/mol, XLogP of 2.39, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dihydroindol-1-yl)-1-(3-methoxyphenyl)pyrrolidine-2,5-dione is sourced from PubChem (CID 2931733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).