N-(3-methoxyphenyl)-1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide

C19H20N2O3 — CID 3107619

IUPACN-(3-methoxyphenyl)-1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide
SMILESCOc1cccc(NC(=O)C2CC(=O)N(c3ccc(C)cc3)C2)c1
InChIInChI=1S/C19H20N2O3/c1-13-6-8-16(9-7-13)21-12-14(10-18(21)22)19(23)20-15-4-3-5-17(11-15)24-2/h3-9,11,14H,10,12H2,1-2H3,(H,20,23)
InChIKeyQJGWABJWIZVKDA-UHFFFAOYSA-N
MW324.38 g/mol
LogP3.00
Rot. Bonds4

About N-(3-methoxyphenyl)-1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide

N-(3-methoxyphenyl)-1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide (PubChem CID 3107619) has the molecular formula C19H20N2O3 and a molecular weight of 324.38 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide
PubChem CID3107619
Molecular FormulaC19H20N2O3
Molecular Weight324.38 g/mol
Exact Mass324.15
IUPAC NameN-(3-methoxyphenyl)-1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide
SMILESCOc1cccc(NC(=O)C2CC(=O)N(c3ccc(C)cc3)C2)c1
InChIInChI=1S/C19H20N2O3/c1-13-6-8-16(9-7-13)21-12-14(10-18(21)22)19(23)20-15-4-3-5-17(11-15)24-2/h3-9,11,14H,10,12H2,1-2H3,(H,20,23)
InChIKeyQJGWABJWIZVKDA-UHFFFAOYSA-N
XLogP3.00
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of N-(3-methoxyphenyl)-1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide (CID 3107619) is N-(3-methoxyphenyl)-1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for N-(3-methoxyphenyl)-1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for N-(3-methoxyphenyl)-1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide is COc1cccc(NC(=O)C2CC(=O)N(c3ccc(C)cc3)C2)c1.
What is the InChIKey of N-(3-methoxyphenyl)-1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide?
The InChIKey is QJGWABJWIZVKDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O3/c1-13-6-8-16(9-7-13)21-12-14(10-18(21)22)19(23)20-15-4-3-5-17(11-15)24-2/h3-9,11,14H,10,12H2,1-2H3,(H,20,23).
What are the key properties of N-(3-methoxyphenyl)-1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide?
N-(3-methoxyphenyl)-1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide has a molecular weight of 324.38 g/mol, XLogP of 3.00, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 3107619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).