N-[[5-oxo-1-[4-(2-oxo-1-pyridinyl)phenyl]pyrrolidin-3-yl]methyl]benzamide

C23H21N3O3 — CID 18448030

IUPACN-[[5-oxo-1-[4-(2-oxo-1-pyridinyl)phenyl]pyrrolidin-3-yl]methyl]benzamide
SMILESO=C(NCC1CC(=O)N(c2ccc(-n3ccccc3=O)cc2)C1)c1ccccc1
InChIInChI=1S/C23H21N3O3/c27-21-8-4-5-13-25(21)19-9-11-20(12-10-19)26-16-17(14-22(26)28)15-24-23(29)18-6-2-1-3-7-18/h1-13,17H,14-16H2,(H,24,29)
InChIKeyZUNDRHOXFYTCGD-UHFFFAOYSA-N
MW387.44 g/mol
LogP2.62
Rot. Bonds5

About N-[[5-oxo-1-[4-(2-oxo-1-pyridinyl)phenyl]pyrrolidin-3-yl]methyl]benzamide

N-[[5-oxo-1-[4-(2-oxo-1-pyridinyl)phenyl]pyrrolidin-3-yl]methyl]benzamide (PubChem CID 18448030) has the molecular formula C23H21N3O3 and a molecular weight of 387.44 g/mol. Its IUPAC name is N-[[5-oxo-1-[4-(2-oxo-1-pyridinyl)phenyl]pyrrolidin-3-yl]methyl]benzamide.

Molecular Properties

Compound NameN-[[5-oxo-1-[4-(2-oxo-1-pyridinyl)phenyl]pyrrolidin-3-yl]methyl]benzamide
PubChem CID18448030
Molecular FormulaC23H21N3O3
Molecular Weight387.44 g/mol
Exact Mass387.16
IUPAC NameN-[[5-oxo-1-[4-(2-oxo-1-pyridinyl)phenyl]pyrrolidin-3-yl]methyl]benzamide
SMILESO=C(NCC1CC(=O)N(c2ccc(-n3ccccc3=O)cc2)C1)c1ccccc1
InChIInChI=1S/C23H21N3O3/c27-21-8-4-5-13-25(21)19-9-11-20(12-10-19)26-16-17(14-22(26)28)15-24-23(29)18-6-2-1-3-7-18/h1-13,17H,14-16H2,(H,24,29)
InChIKeyZUNDRHOXFYTCGD-UHFFFAOYSA-N
XLogP2.62
TPSA71.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.44
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-methyl-N-[(5-oxo-1-phenylpyrrolidin-3-yl)methyl]benzamide
CID 16918211
3-methyl-N-[[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]methyl]benzamide
CID 40876165
3-nitro-N-[(5-oxo-1-phenylpyrrolidin-3-yl)methyl]benzamide
CID 16918248
4-chloro-N-[[1-(4-methylphenyl)-5-oxopyrrolidin-3-yl]methyl]benzamide
CID 16918995
4-ethoxy-N-[[1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]methyl]benzamide
CID 16918523
4-tert-butyl-N-[[1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]methyl]benzamide
CID 16918670
N-[[(3R)-1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]methyl]-2-phenylacetamide
CID 40895899
N-[[(3R)-1-(4-methoxyphenyl)-5-oxopyrrolidin-3-yl]methyl]-4-methylbenzamide
CID 40876664
methyl 2-[(5-oxo-1-phenylpyrrolidin-3-yl)methylcarbamoyl]benzoate
CID 16918311
4-morpholin-4-ylsulfonyl-N-[(5-oxo-1-phenylpyrrolidin-3-yl)methyl]benzamide
CID 16918301
N-[(5-oxo-1-phenylpyrrolidin-3-yl)methyl]-2,2-diphenylacetamide
CID 16918291
N-[(5-oxo-1-phenylpyrrolidin-3-yl)methyl]-2-propylpentanamide
CID 16918191

Frequently Asked Questions

What is the IUPAC name of N-[[5-oxo-1-[4-(2-oxo-1-pyridinyl)phenyl]pyrrolidin-3-yl]methyl]benzamide?
The IUPAC name of N-[[5-oxo-1-[4-(2-oxo-1-pyridinyl)phenyl]pyrrolidin-3-yl]methyl]benzamide (CID 18448030) is N-[[5-oxo-1-[4-(2-oxo-1-pyridinyl)phenyl]pyrrolidin-3-yl]methyl]benzamide.
What is the SMILES notation for N-[[5-oxo-1-[4-(2-oxo-1-pyridinyl)phenyl]pyrrolidin-3-yl]methyl]benzamide?
The canonical SMILES for N-[[5-oxo-1-[4-(2-oxo-1-pyridinyl)phenyl]pyrrolidin-3-yl]methyl]benzamide is O=C(NCC1CC(=O)N(c2ccc(-n3ccccc3=O)cc2)C1)c1ccccc1.
What is the InChIKey of N-[[5-oxo-1-[4-(2-oxo-1-pyridinyl)phenyl]pyrrolidin-3-yl]methyl]benzamide?
The InChIKey is ZUNDRHOXFYTCGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N3O3/c27-21-8-4-5-13-25(21)19-9-11-20(12-10-19)26-16-17(14-22(26)28)15-24-23(29)18-6-2-1-3-7-18/h1-13,17H,14-16H2,(H,24,29).
What are the key properties of N-[[5-oxo-1-[4-(2-oxo-1-pyridinyl)phenyl]pyrrolidin-3-yl]methyl]benzamide?
N-[[5-oxo-1-[4-(2-oxo-1-pyridinyl)phenyl]pyrrolidin-3-yl]methyl]benzamide has a molecular weight of 387.44 g/mol, XLogP of 2.62, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-oxo-1-[4-(2-oxo-1-pyridinyl)phenyl]pyrrolidin-3-yl]methyl]benzamide is sourced from PubChem (CID 18448030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).