5-oxo-N-[(2-oxo-1H-quinolin-3-yl)methyl]-1-phenylpyrrolidine-2-carboxamide

C21H19N3O3 — CID 110608828

IUPAC5-oxo-N-[(2-oxo-1H-quinolin-3-yl)methyl]-1-phenylpyrrolidine-2-carboxamide
SMILESO=C(NCc1cc2ccccc2[nH]c1=O)C1CCC(=O)N1c1ccccc1
InChIInChI=1S/C21H19N3O3/c25-19-11-10-18(24(19)16-7-2-1-3-8-16)21(27)22-13-15-12-14-6-4-5-9-17(14)23-20(15)26/h1-9,12,18H,10-11,13H2,(H,22,27)(H,23,26)
InChIKeyVGOYEGMOOCOFDZ-UHFFFAOYSA-N
MW361.40 g/mol
LogP2.34
Rot. Bonds4

About 5-oxo-N-[(2-oxo-1H-quinolin-3-yl)methyl]-1-phenylpyrrolidine-2-carboxamide

5-oxo-N-[(2-oxo-1H-quinolin-3-yl)methyl]-1-phenylpyrrolidine-2-carboxamide (PubChem CID 110608828) has the molecular formula C21H19N3O3 and a molecular weight of 361.40 g/mol. Its IUPAC name is 5-oxo-N-[(2-oxo-1H-quinolin-3-yl)methyl]-1-phenylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name5-oxo-N-[(2-oxo-1H-quinolin-3-yl)methyl]-1-phenylpyrrolidine-2-carboxamide
PubChem CID110608828
Molecular FormulaC21H19N3O3
Molecular Weight361.40 g/mol
Exact Mass361.14
IUPAC Name5-oxo-N-[(2-oxo-1H-quinolin-3-yl)methyl]-1-phenylpyrrolidine-2-carboxamide
SMILESO=C(NCc1cc2ccccc2[nH]c1=O)C1CCC(=O)N1c1ccccc1
InChIInChI=1S/C21H19N3O3/c25-19-11-10-18(24(19)16-7-2-1-3-8-16)21(27)22-13-15-12-14-6-4-5-9-17(14)23-20(15)26/h1-9,12,18H,10-11,13H2,(H,22,27)(H,23,26)
InChIKeyVGOYEGMOOCOFDZ-UHFFFAOYSA-N
XLogP2.34
TPSA82.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.40
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1H-indol-2-ylmethyl)-1-(5-oxo-1-phenylpyrrolidine-2-carbonyl)pyrrolidine-3-carboxamide
CID 172898736
5-oxo-1-phenyl-N-prop-2-enylpyrrolidine-2-carboxamide
CID 110406517
N-benzyl-1-(4-methylphenyl)-5-oxopyrrolidine-2-carboxamide
CID 110373746
N-(3-acetamidopropyl)-5-oxo-1-phenylpyrrolidine-2-carboxamide
CID 110630711
1-(4-chlorophenyl)-N-[(2-methoxyphenyl)methyl]-5-oxopyrrolidine-2-carboxamide
CID 110374015
N-(2-methyl-3-phenylpropyl)-5-oxo-1-phenylpyrrolidine-2-carboxamide
CID 110608605
2-(3-methyl-2-oxo-1H-quinolin-6-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]acetamide
CID 110616680
N-[2-(1,3-benzodioxol-5-yl)ethyl]-5-oxo-1-phenylpyrrolidine-2-carboxamide
CID 110606566
N-[(2-oxo-1H-quinolin-3-yl)methyl]-2-(5-phenyl-1,2-oxazol-3-yl)acetamide
CID 110619588
N'-(3-bicyclo[3.3.1]nonanyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]oxamide
CID 167835459
N-(3,5-dichlorophenyl)-5-oxo-1-phenylpyrrolidine-2-carboxamide
CID 110427657
N-butan-2-yl-5-oxo-1-phenylpyrrolidine-2-carboxamide
CID 110406874

Frequently Asked Questions

What is the IUPAC name of 5-oxo-N-[(2-oxo-1H-quinolin-3-yl)methyl]-1-phenylpyrrolidine-2-carboxamide?
The IUPAC name of 5-oxo-N-[(2-oxo-1H-quinolin-3-yl)methyl]-1-phenylpyrrolidine-2-carboxamide (CID 110608828) is 5-oxo-N-[(2-oxo-1H-quinolin-3-yl)methyl]-1-phenylpyrrolidine-2-carboxamide.
What is the SMILES notation for 5-oxo-N-[(2-oxo-1H-quinolin-3-yl)methyl]-1-phenylpyrrolidine-2-carboxamide?
The canonical SMILES for 5-oxo-N-[(2-oxo-1H-quinolin-3-yl)methyl]-1-phenylpyrrolidine-2-carboxamide is O=C(NCc1cc2ccccc2[nH]c1=O)C1CCC(=O)N1c1ccccc1.
What is the InChIKey of 5-oxo-N-[(2-oxo-1H-quinolin-3-yl)methyl]-1-phenylpyrrolidine-2-carboxamide?
The InChIKey is VGOYEGMOOCOFDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N3O3/c25-19-11-10-18(24(19)16-7-2-1-3-8-16)21(27)22-13-15-12-14-6-4-5-9-17(14)23-20(15)26/h1-9,12,18H,10-11,13H2,(H,22,27)(H,23,26).
What are the key properties of 5-oxo-N-[(2-oxo-1H-quinolin-3-yl)methyl]-1-phenylpyrrolidine-2-carboxamide?
5-oxo-N-[(2-oxo-1H-quinolin-3-yl)methyl]-1-phenylpyrrolidine-2-carboxamide has a molecular weight of 361.40 g/mol, XLogP of 2.34, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxo-N-[(2-oxo-1H-quinolin-3-yl)methyl]-1-phenylpyrrolidine-2-carboxamide is sourced from PubChem (CID 110608828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).