2-[5-[2-(2,5-dimethylphenyl)pyrrolidine-1-carbonyl]-2-oxo-1-pyridinyl]acetamide

C20H23N3O3 — CID 110246981

IUPAC2-[5-[2-(2,5-dimethylphenyl)pyrrolidine-1-carbonyl]-2-oxo-1-pyridinyl]acetamide
SMILESCc1ccc(C)c(C2CCCN2C(=O)c2ccc(=O)n(CC(N)=O)c2)c1
InChIInChI=1S/C20H23N3O3/c1-13-5-6-14(2)16(10-13)17-4-3-9-23(17)20(26)15-7-8-19(25)22(11-15)12-18(21)24/h5-8,10-11,17H,3-4,9,12H2,1-2H3,(H2,21,24)
InChIKeyDGYAWSUYSQQHEP-UHFFFAOYSA-N
MW353.42 g/mol
LogP1.93
Rot. Bonds4

About 2-[5-[2-(2,5-dimethylphenyl)pyrrolidine-1-carbonyl]-2-oxo-1-pyridinyl]acetamide

2-[5-[2-(2,5-dimethylphenyl)pyrrolidine-1-carbonyl]-2-oxo-1-pyridinyl]acetamide (PubChem CID 110246981) has the molecular formula C20H23N3O3 and a molecular weight of 353.42 g/mol. Its IUPAC name is 2-[5-[2-(2,5-dimethylphenyl)pyrrolidine-1-carbonyl]-2-oxo-1-pyridinyl]acetamide.

Molecular Properties

Compound Name2-[5-[2-(2,5-dimethylphenyl)pyrrolidine-1-carbonyl]-2-oxo-1-pyridinyl]acetamide
PubChem CID110246981
Molecular FormulaC20H23N3O3
Molecular Weight353.42 g/mol
Exact Mass353.17
IUPAC Name2-[5-[2-(2,5-dimethylphenyl)pyrrolidine-1-carbonyl]-2-oxo-1-pyridinyl]acetamide
SMILESCc1ccc(C)c(C2CCCN2C(=O)c2ccc(=O)n(CC(N)=O)c2)c1
InChIInChI=1S/C20H23N3O3/c1-13-5-6-14(2)16(10-13)17-4-3-9-23(17)20(26)15-7-8-19(25)22(11-15)12-18(21)24/h5-8,10-11,17H,3-4,9,12H2,1-2H3,(H2,21,24)
InChIKeyDGYAWSUYSQQHEP-UHFFFAOYSA-N
XLogP1.93
TPSA85.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.42
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[5-[2-(2,5-dimethylphenyl)pyrrolidine-1-carbonyl]-2-oxo-1-pyridinyl]-N-(1,3-thiazol-2-yl)acetamide
CID 110246974
1-[4-[2-(2,5-dimethylphenyl)pyrrolidine-1-carbonyl]phenyl]imidazolidin-2-one
CID 139007333
[2-(2,5-dimethylphenyl)pyrrolidin-1-yl]-[2-(2-methylpropyl)pyrazol-3-yl]methanone
CID 138058613
1-(2-methoxyethyl)-5-[(2S)-2-(3-methylphenyl)pyrrolidine-1-carbonyl]pyridin-2-one
CID 94635762
1-[2-(2,5-dimethylphenyl)pyrrolidin-1-yl]-2-(methylamino)ethanone
CID 83625368
[2-(2,5-dimethylphenyl)pyrrolidin-1-yl]-(1,2-oxazol-3-yl)methanone
CID 71917445
2-(2,5-dimethylphenyl)piperidine-1-carbothioamide
CID 141244951
[2-(2,5-dimethylphenyl)pyrrolidin-1-yl]-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)methanone
CID 136515149
N-cyclohexyl-2-[3-[2-(2,5-dimethylphenyl)pyrrolidine-1-carbonyl]-2-oxo-1-pyridinyl]acetamide
CID 110246846
5-[2-(2,5-dimethylphenyl)pyrrolidin-1-yl]-3,3-difluoro-5-oxopentanoic acid
CID 166288514
(3,4-dimethoxyphenyl)-[(2R)-2-(2-methylphenyl)pyrrolidin-1-yl]methanone
CID 51856046
N-cyclopentyl-1-[2-[2-(2,5-dimethylphenyl)pyrrolidin-1-yl]-2-oxoethyl]-2-oxopyridine-3-carboxamide
CID 110246780

Frequently Asked Questions

What is the IUPAC name of 2-[5-[2-(2,5-dimethylphenyl)pyrrolidine-1-carbonyl]-2-oxo-1-pyridinyl]acetamide?
The IUPAC name of 2-[5-[2-(2,5-dimethylphenyl)pyrrolidine-1-carbonyl]-2-oxo-1-pyridinyl]acetamide (CID 110246981) is 2-[5-[2-(2,5-dimethylphenyl)pyrrolidine-1-carbonyl]-2-oxo-1-pyridinyl]acetamide.
What is the SMILES notation for 2-[5-[2-(2,5-dimethylphenyl)pyrrolidine-1-carbonyl]-2-oxo-1-pyridinyl]acetamide?
The canonical SMILES for 2-[5-[2-(2,5-dimethylphenyl)pyrrolidine-1-carbonyl]-2-oxo-1-pyridinyl]acetamide is Cc1ccc(C)c(C2CCCN2C(=O)c2ccc(=O)n(CC(N)=O)c2)c1.
What is the InChIKey of 2-[5-[2-(2,5-dimethylphenyl)pyrrolidine-1-carbonyl]-2-oxo-1-pyridinyl]acetamide?
The InChIKey is DGYAWSUYSQQHEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O3/c1-13-5-6-14(2)16(10-13)17-4-3-9-23(17)20(26)15-7-8-19(25)22(11-15)12-18(21)24/h5-8,10-11,17H,3-4,9,12H2,1-2H3,(H2,21,24).
What are the key properties of 2-[5-[2-(2,5-dimethylphenyl)pyrrolidine-1-carbonyl]-2-oxo-1-pyridinyl]acetamide?
2-[5-[2-(2,5-dimethylphenyl)pyrrolidine-1-carbonyl]-2-oxo-1-pyridinyl]acetamide has a molecular weight of 353.42 g/mol, XLogP of 1.93, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-[2-(2,5-dimethylphenyl)pyrrolidine-1-carbonyl]-2-oxo-1-pyridinyl]acetamide is sourced from PubChem (CID 110246981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).