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

C19H17ClN2O3 — CID 3152007

IUPAC1-(5-chloro-2-methoxyphenyl)-3-(2,3-dihydroindol-1-yl)pyrrolidine-2,5-dione
SMILESCOc1ccc(Cl)cc1N1C(=O)CC(N2CCc3ccccc32)C1=O
InChIInChI=1S/C19H17ClN2O3/c1-25-17-7-6-13(20)10-15(17)22-18(23)11-16(19(22)24)21-9-8-12-4-2-3-5-14(12)21/h2-7,10,16H,8-9,11H2,1H3
InChIKeySXYVZRDQJKHAOX-UHFFFAOYSA-N
MW356.81 g/mol
LogP3.04
Rot. Bonds3

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

1-(5-chloro-2-methoxyphenyl)-3-(2,3-dihydroindol-1-yl)pyrrolidine-2,5-dione (PubChem CID 3152007) has the molecular formula C19H17ClN2O3 and a molecular weight of 356.81 g/mol. Its IUPAC name is 1-(5-chloro-2-methoxyphenyl)-3-(2,3-dihydroindol-1-yl)pyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-(5-chloro-2-methoxyphenyl)-3-(2,3-dihydroindol-1-yl)pyrrolidine-2,5-dione
PubChem CID3152007
Molecular FormulaC19H17ClN2O3
Molecular Weight356.81 g/mol
Exact Mass356.09
IUPAC Name1-(5-chloro-2-methoxyphenyl)-3-(2,3-dihydroindol-1-yl)pyrrolidine-2,5-dione
SMILESCOc1ccc(Cl)cc1N1C(=O)CC(N2CCc3ccccc32)C1=O
InChIInChI=1S/C19H17ClN2O3/c1-25-17-7-6-13(20)10-15(17)22-18(23)11-16(19(22)24)21-9-8-12-4-2-3-5-14(12)21/h2-7,10,16H,8-9,11H2,1H3
InChIKeySXYVZRDQJKHAOX-UHFFFAOYSA-N
XLogP3.04
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.81
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(5-chloro-2-methoxyphenyl)-3-(2,3-dihydroindol-1-yl)pyrrolidine-2,5-dione?
The IUPAC name of 1-(5-chloro-2-methoxyphenyl)-3-(2,3-dihydroindol-1-yl)pyrrolidine-2,5-dione (CID 3152007) is 1-(5-chloro-2-methoxyphenyl)-3-(2,3-dihydroindol-1-yl)pyrrolidine-2,5-dione.
What is the SMILES notation for 1-(5-chloro-2-methoxyphenyl)-3-(2,3-dihydroindol-1-yl)pyrrolidine-2,5-dione?
The canonical SMILES for 1-(5-chloro-2-methoxyphenyl)-3-(2,3-dihydroindol-1-yl)pyrrolidine-2,5-dione is COc1ccc(Cl)cc1N1C(=O)CC(N2CCc3ccccc32)C1=O.
What is the InChIKey of 1-(5-chloro-2-methoxyphenyl)-3-(2,3-dihydroindol-1-yl)pyrrolidine-2,5-dione?
The InChIKey is SXYVZRDQJKHAOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClN2O3/c1-25-17-7-6-13(20)10-15(17)22-18(23)11-16(19(22)24)21-9-8-12-4-2-3-5-14(12)21/h2-7,10,16H,8-9,11H2,1H3.
What are the key properties of 1-(5-chloro-2-methoxyphenyl)-3-(2,3-dihydroindol-1-yl)pyrrolidine-2,5-dione?
1-(5-chloro-2-methoxyphenyl)-3-(2,3-dihydroindol-1-yl)pyrrolidine-2,5-dione has a molecular weight of 356.81 g/mol, XLogP of 3.04, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-chloro-2-methoxyphenyl)-3-(2,3-dihydroindol-1-yl)pyrrolidine-2,5-dione is sourced from PubChem (CID 3152007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).