5-chloro-N-(3-chlorophenyl)-2-methoxy-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide

C19H18Cl2N2O3 — CID 4582519

IUPAC5-chloro-N-(3-chlorophenyl)-2-methoxy-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide
SMILESCOc1ccc(Cl)cc1C(=O)N(CN1CCCC1=O)c1cccc(Cl)c1
InChIInChI=1S/C19H18Cl2N2O3/c1-26-17-8-7-14(21)11-16(17)19(25)23(12-22-9-3-6-18(22)24)15-5-2-4-13(20)10-15/h2,4-5,7-8,10-11H,3,6,9,12H2,1H3
InChIKeyIQCWUFDORPQGBQ-UHFFFAOYSA-N
MW393.27 g/mol
LogP4.23
Rot. Bonds5

About 5-chloro-N-(3-chlorophenyl)-2-methoxy-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide

5-chloro-N-(3-chlorophenyl)-2-methoxy-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide (PubChem CID 4582519) has the molecular formula C19H18Cl2N2O3 and a molecular weight of 393.27 g/mol. Its IUPAC name is 5-chloro-N-(3-chlorophenyl)-2-methoxy-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide.

Molecular Properties

Compound Name5-chloro-N-(3-chlorophenyl)-2-methoxy-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide
PubChem CID4582519
Molecular FormulaC19H18Cl2N2O3
Molecular Weight393.27 g/mol
Exact Mass392.07
IUPAC Name5-chloro-N-(3-chlorophenyl)-2-methoxy-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide
SMILESCOc1ccc(Cl)cc1C(=O)N(CN1CCCC1=O)c1cccc(Cl)c1
InChIInChI=1S/C19H18Cl2N2O3/c1-26-17-8-7-14(21)11-16(17)19(25)23(12-22-9-3-6-18(22)24)15-5-2-4-13(20)10-15/h2,4-5,7-8,10-11H,3,6,9,12H2,1H3
InChIKeyIQCWUFDORPQGBQ-UHFFFAOYSA-N
XLogP4.23
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.27
LogP ≤ 54.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(3-chlorophenyl)-2-methoxy-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide?
The IUPAC name of 5-chloro-N-(3-chlorophenyl)-2-methoxy-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide (CID 4582519) is 5-chloro-N-(3-chlorophenyl)-2-methoxy-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide.
What is the SMILES notation for 5-chloro-N-(3-chlorophenyl)-2-methoxy-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide?
The canonical SMILES for 5-chloro-N-(3-chlorophenyl)-2-methoxy-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide is COc1ccc(Cl)cc1C(=O)N(CN1CCCC1=O)c1cccc(Cl)c1.
What is the InChIKey of 5-chloro-N-(3-chlorophenyl)-2-methoxy-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide?
The InChIKey is IQCWUFDORPQGBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18Cl2N2O3/c1-26-17-8-7-14(21)11-16(17)19(25)23(12-22-9-3-6-18(22)24)15-5-2-4-13(20)10-15/h2,4-5,7-8,10-11H,3,6,9,12H2,1H3.
What are the key properties of 5-chloro-N-(3-chlorophenyl)-2-methoxy-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide?
5-chloro-N-(3-chlorophenyl)-2-methoxy-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide has a molecular weight of 393.27 g/mol, XLogP of 4.23, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(3-chlorophenyl)-2-methoxy-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide is sourced from PubChem (CID 4582519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).