N'-(2-methoxyphenyl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]oxamide

C19H19N3O4 — CID 30679226

IUPACN'-(2-methoxyphenyl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]oxamide
SMILESCOc1ccccc1NC(=O)C(=O)Nc1ccc(N2CCCC2=O)cc1
InChIInChI=1S/C19H19N3O4/c1-26-16-6-3-2-5-15(16)21-19(25)18(24)20-13-8-10-14(11-9-13)22-12-4-7-17(22)23/h2-3,5-6,8-11H,4,7,12H2,1H3,(H,20,24)(H,21,25)
InChIKeyRPFRQDAVNAHCCK-UHFFFAOYSA-N
MW353.38 g/mol
LogP2.40
Rot. Bonds4

About N'-(2-methoxyphenyl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]oxamide

N'-(2-methoxyphenyl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]oxamide (PubChem CID 30679226) has the molecular formula C19H19N3O4 and a molecular weight of 353.38 g/mol. Its IUPAC name is N'-(2-methoxyphenyl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]oxamide.

Molecular Properties

Compound NameN'-(2-methoxyphenyl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]oxamide
PubChem CID30679226
Molecular FormulaC19H19N3O4
Molecular Weight353.38 g/mol
Exact Mass353.14
IUPAC NameN'-(2-methoxyphenyl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]oxamide
SMILESCOc1ccccc1NC(=O)C(=O)Nc1ccc(N2CCCC2=O)cc1
InChIInChI=1S/C19H19N3O4/c1-26-16-6-3-2-5-15(16)21-19(25)18(24)20-13-8-10-14(11-9-13)22-12-4-7-17(22)23/h2-3,5-6,8-11H,4,7,12H2,1H3,(H,20,24)(H,21,25)
InChIKeyRPFRQDAVNAHCCK-UHFFFAOYSA-N
XLogP2.40
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.38
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N'-(2-methoxyphenyl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]oxamide?
The IUPAC name of N'-(2-methoxyphenyl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]oxamide (CID 30679226) is N'-(2-methoxyphenyl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]oxamide.
What is the SMILES notation for N'-(2-methoxyphenyl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]oxamide?
The canonical SMILES for N'-(2-methoxyphenyl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]oxamide is COc1ccccc1NC(=O)C(=O)Nc1ccc(N2CCCC2=O)cc1.
What is the InChIKey of N'-(2-methoxyphenyl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]oxamide?
The InChIKey is RPFRQDAVNAHCCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O4/c1-26-16-6-3-2-5-15(16)21-19(25)18(24)20-13-8-10-14(11-9-13)22-12-4-7-17(22)23/h2-3,5-6,8-11H,4,7,12H2,1H3,(H,20,24)(H,21,25).
What are the key properties of N'-(2-methoxyphenyl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]oxamide?
N'-(2-methoxyphenyl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]oxamide has a molecular weight of 353.38 g/mol, XLogP of 2.40, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-methoxyphenyl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]oxamide is sourced from PubChem (CID 30679226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).