2-methoxy-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]benzamide

C19H20N2O3 — CID 27171286

IUPAC2-methoxy-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]benzamide
SMILESCOc1ccccc1C(=O)NCc1ccc(N2CCCC2=O)cc1
InChIInChI=1S/C19H20N2O3/c1-24-17-6-3-2-5-16(17)19(23)20-13-14-8-10-15(11-9-14)21-12-4-7-18(21)22/h2-3,5-6,8-11H,4,7,12-13H2,1H3,(H,20,23)
InChIKeyXMEZHFDWNASFAQ-UHFFFAOYSA-N
MW324.38 g/mol
LogP2.75
Rot. Bonds5

About 2-methoxy-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]benzamide

2-methoxy-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]benzamide (PubChem CID 27171286) has the molecular formula C19H20N2O3 and a molecular weight of 324.38 g/mol. Its IUPAC name is 2-methoxy-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]benzamide.

Molecular Properties

Compound Name2-methoxy-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]benzamide
PubChem CID27171286
Molecular FormulaC19H20N2O3
Molecular Weight324.38 g/mol
Exact Mass324.15
IUPAC Name2-methoxy-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]benzamide
SMILESCOc1ccccc1C(=O)NCc1ccc(N2CCCC2=O)cc1
InChIInChI=1S/C19H20N2O3/c1-24-17-6-3-2-5-16(17)19(23)20-13-14-8-10-15(11-9-14)21-12-4-7-18(21)22/h2-3,5-6,8-11H,4,7,12-13H2,1H3,(H,20,23)
InChIKeyXMEZHFDWNASFAQ-UHFFFAOYSA-N
XLogP2.75
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]benzamide?
The IUPAC name of 2-methoxy-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]benzamide (CID 27171286) is 2-methoxy-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]benzamide.
What is the SMILES notation for 2-methoxy-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]benzamide?
The canonical SMILES for 2-methoxy-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]benzamide is COc1ccccc1C(=O)NCc1ccc(N2CCCC2=O)cc1.
What is the InChIKey of 2-methoxy-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]benzamide?
The InChIKey is XMEZHFDWNASFAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O3/c1-24-17-6-3-2-5-16(17)19(23)20-13-14-8-10-15(11-9-14)21-12-4-7-18(21)22/h2-3,5-6,8-11H,4,7,12-13H2,1H3,(H,20,23).
What are the key properties of 2-methoxy-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]benzamide?
2-methoxy-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]benzamide has a molecular weight of 324.38 g/mol, XLogP of 2.75, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]benzamide is sourced from PubChem (CID 27171286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).