(3R)-1-naphthalen-1-yl-5-oxo-N-(4-oxo-1H-pyridin-3-yl)pyrrolidine-3-carboxamide

C20H17N3O3 — CID 52527278

IUPAC(3R)-1-naphthalen-1-yl-5-oxo-N-(4-oxo-1H-pyridin-3-yl)pyrrolidine-3-carboxamide
SMILESO=C(Nc1c[nH]ccc1=O)[C@@H]1CC(=O)N(c2cccc3ccccc23)C1
InChIInChI=1S/C20H17N3O3/c24-18-8-9-21-11-16(18)22-20(26)14-10-19(25)23(12-14)17-7-3-5-13-4-1-2-6-15(13)17/h1-9,11,14H,10,12H2,(H,21,24)(H,22,26)/t14-/m1/s1
InChIKeyZANIXIKJXVAIJP-CQSZACIVSA-N
MW347.37 g/mol
LogP2.52
Rot. Bonds3

About (3R)-1-naphthalen-1-yl-5-oxo-N-(4-oxo-1H-pyridin-3-yl)pyrrolidine-3-carboxamide

(3R)-1-naphthalen-1-yl-5-oxo-N-(4-oxo-1H-pyridin-3-yl)pyrrolidine-3-carboxamide (PubChem CID 52527278) has the molecular formula C20H17N3O3 and a molecular weight of 347.37 g/mol. Its IUPAC name is (3R)-1-naphthalen-1-yl-5-oxo-N-(4-oxo-1H-pyridin-3-yl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-1-naphthalen-1-yl-5-oxo-N-(4-oxo-1H-pyridin-3-yl)pyrrolidine-3-carboxamide
PubChem CID52527278
Molecular FormulaC20H17N3O3
Molecular Weight347.37 g/mol
Exact Mass347.13
IUPAC Name(3R)-1-naphthalen-1-yl-5-oxo-N-(4-oxo-1H-pyridin-3-yl)pyrrolidine-3-carboxamide
SMILESO=C(Nc1c[nH]ccc1=O)[C@@H]1CC(=O)N(c2cccc3ccccc23)C1
InChIInChI=1S/C20H17N3O3/c24-18-8-9-21-11-16(18)22-20(26)14-10-19(25)23(12-14)17-7-3-5-13-4-1-2-6-15(13)17/h1-9,11,14H,10,12H2,(H,21,24)(H,22,26)/t14-/m1/s1
InChIKeyZANIXIKJXVAIJP-CQSZACIVSA-N
XLogP2.52
TPSA82.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.37
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-hydroxyphenyl)-1-naphthalen-1-yl-5-oxopyrrolidine-3-carboxamide
CID 46665270
(3S)-N-(2-methylphenyl)-1-naphthalen-1-yl-5-oxopyrrolidine-3-carboxamide
CID 26914330
(3S)-N-(2-morpholin-4-ylphenyl)-1-naphthalen-1-yl-5-oxopyrrolidine-3-carboxamide
CID 9461562
(3S)-N-(2-methoxyphenyl)-1-naphthalen-1-yl-5-oxopyrrolidine-3-carboxamide
CID 26914917
N-methyl-1-naphthalen-1-yl-5-oxopyrrolidine-3-carboxamide
CID 47099878
(3R)-N-(2,5-dichlorophenyl)-1-naphthalen-1-yl-5-oxopyrrolidine-3-carboxamide
CID 9005107
(3S)-N-(2,6-dimethylphenyl)-1-naphthalen-1-yl-5-oxopyrrolidine-3-carboxamide
CID 9005100
(3R)-1-(2-ethylphenyl)-N-naphthalen-1-yl-5-oxopyrrolidine-3-carboxamide
CID 9004571
N-(2,5-dimethoxyphenyl)-1-naphthalen-1-yl-5-oxopyrrolidine-3-carboxamide
CID 46423944
(3S)-N-(4,5-dimethoxy-2-methylphenyl)-1-naphthalen-1-yl-5-oxopyrrolidine-3-carboxamide
CID 26209339
N-(4-chloro-2,5-dimethoxyphenyl)-1-naphthalen-1-yl-5-oxopyrrolidine-3-carboxamide
CID 42999548
(3R)-N-(5-chloro-2,4-dimethoxyphenyl)-1-naphthalen-1-yl-5-oxopyrrolidine-3-carboxamide
CID 42057854

Frequently Asked Questions

What is the IUPAC name of (3R)-1-naphthalen-1-yl-5-oxo-N-(4-oxo-1H-pyridin-3-yl)pyrrolidine-3-carboxamide?
The IUPAC name of (3R)-1-naphthalen-1-yl-5-oxo-N-(4-oxo-1H-pyridin-3-yl)pyrrolidine-3-carboxamide (CID 52527278) is (3R)-1-naphthalen-1-yl-5-oxo-N-(4-oxo-1H-pyridin-3-yl)pyrrolidine-3-carboxamide.
What is the SMILES notation for (3R)-1-naphthalen-1-yl-5-oxo-N-(4-oxo-1H-pyridin-3-yl)pyrrolidine-3-carboxamide?
The canonical SMILES for (3R)-1-naphthalen-1-yl-5-oxo-N-(4-oxo-1H-pyridin-3-yl)pyrrolidine-3-carboxamide is O=C(Nc1c[nH]ccc1=O)[C@@H]1CC(=O)N(c2cccc3ccccc23)C1.
What is the InChIKey of (3R)-1-naphthalen-1-yl-5-oxo-N-(4-oxo-1H-pyridin-3-yl)pyrrolidine-3-carboxamide?
The InChIKey is ZANIXIKJXVAIJP-CQSZACIVSA-N. The full InChI is InChI=1S/C20H17N3O3/c24-18-8-9-21-11-16(18)22-20(26)14-10-19(25)23(12-14)17-7-3-5-13-4-1-2-6-15(13)17/h1-9,11,14H,10,12H2,(H,21,24)(H,22,26)/t14-/m1/s1.
What are the key properties of (3R)-1-naphthalen-1-yl-5-oxo-N-(4-oxo-1H-pyridin-3-yl)pyrrolidine-3-carboxamide?
(3R)-1-naphthalen-1-yl-5-oxo-N-(4-oxo-1H-pyridin-3-yl)pyrrolidine-3-carboxamide has a molecular weight of 347.37 g/mol, XLogP of 2.52, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-naphthalen-1-yl-5-oxo-N-(4-oxo-1H-pyridin-3-yl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 52527278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).