(2R)-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methyl-5-oxopyrrolidine-2-carboxamide

C15H19N3O4 — CID 9438617

IUPAC(2R)-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methyl-5-oxopyrrolidine-2-carboxamide
SMILESCOc1ccc(NC(=O)CN(C)C(=O)[C@H]2CCC(=O)N2)cc1
InChIInChI=1S/C15H19N3O4/c1-18(15(21)12-7-8-13(19)17-12)9-14(20)16-10-3-5-11(22-2)6-4-10/h3-6,12H,7-9H2,1-2H3,(H,16,20)(H,17,19)/t12-/m1/s1
InChIKeyNCIORAWBUTWPDT-GFCCVEGCSA-N
MW305.33 g/mol
LogP0.37
Rot. Bonds5

About (2R)-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methyl-5-oxopyrrolidine-2-carboxamide

(2R)-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methyl-5-oxopyrrolidine-2-carboxamide (PubChem CID 9438617) has the molecular formula C15H19N3O4 and a molecular weight of 305.33 g/mol. Its IUPAC name is (2R)-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methyl-5-oxopyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methyl-5-oxopyrrolidine-2-carboxamide
PubChem CID9438617
Molecular FormulaC15H19N3O4
Molecular Weight305.33 g/mol
Exact Mass305.14
IUPAC Name(2R)-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methyl-5-oxopyrrolidine-2-carboxamide
SMILESCOc1ccc(NC(=O)CN(C)C(=O)[C@H]2CCC(=O)N2)cc1
InChIInChI=1S/C15H19N3O4/c1-18(15(21)12-7-8-13(19)17-12)9-14(20)16-10-3-5-11(22-2)6-4-10/h3-6,12H,7-9H2,1-2H3,(H,16,20)(H,17,19)/t12-/m1/s1
InChIKeyNCIORAWBUTWPDT-GFCCVEGCSA-N
XLogP0.37
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.33
LogP ≤ 50.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyclopentyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylacetamide
CID 9438651
4-N-[2-(4-methoxyanilino)-2-oxoethyl]-4-N-methyl-1-N-phenylpiperidine-1,4-dicarboxamide
CID 9438322
2-[[2-(cyclopropylcarbamoylamino)-2-oxoethyl]-methylamino]-N-(4-methoxyphenyl)acetamide
CID 9222752
N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methyl-1-(2-methylbenzoyl)piperidine-4-carboxamide
CID 18112338
2-[[2-(4-methoxyphenoxy)acetyl]-methylamino]-N-(4-methoxyphenyl)acetamide
CID 7719333
N-[2-(4-methoxyanilino)-2-oxoethyl]-N,3-dimethylbutanamide
CID 9438619
3-[(3aS,7aS)-1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl]-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylpropanamide
CID 8501372
N-[2-(4-methoxyanilino)-2-oxoethyl]-3-(4-methoxyphenyl)-N-methylpropanamide
CID 7936687
N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methyl-4-[(2-methylcyclopropanecarbonyl)amino]benzamide
CID 46431000
2-cyclopropyl-N-(4-methoxyphenyl)acetamide
CID 3008382
2-hydroxy-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylbenzamide
CID 39122596
2-[(2-hydroxycyclopentyl)methyl-methylamino]-N-(4-methoxyphenyl)acetamide
CID 109397914

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methyl-5-oxopyrrolidine-2-carboxamide?
The IUPAC name of (2R)-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methyl-5-oxopyrrolidine-2-carboxamide (CID 9438617) is (2R)-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methyl-5-oxopyrrolidine-2-carboxamide.
What is the SMILES notation for (2R)-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methyl-5-oxopyrrolidine-2-carboxamide?
The canonical SMILES for (2R)-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methyl-5-oxopyrrolidine-2-carboxamide is COc1ccc(NC(=O)CN(C)C(=O)[C@H]2CCC(=O)N2)cc1.
What is the InChIKey of (2R)-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methyl-5-oxopyrrolidine-2-carboxamide?
The InChIKey is NCIORAWBUTWPDT-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H19N3O4/c1-18(15(21)12-7-8-13(19)17-12)9-14(20)16-10-3-5-11(22-2)6-4-10/h3-6,12H,7-9H2,1-2H3,(H,16,20)(H,17,19)/t12-/m1/s1.
What are the key properties of (2R)-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methyl-5-oxopyrrolidine-2-carboxamide?
(2R)-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methyl-5-oxopyrrolidine-2-carboxamide has a molecular weight of 305.33 g/mol, XLogP of 0.37, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methyl-5-oxopyrrolidine-2-carboxamide is sourced from PubChem (CID 9438617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).