N-ethyl-2-[1-(2-methylbenzoyl)pyrrolidin-3-yl]oxypyridine-3-carboxamide

C20H23N3O3 — CID 91914015

IUPACN-ethyl-2-[1-(2-methylbenzoyl)pyrrolidin-3-yl]oxypyridine-3-carboxamide
SMILESCCNC(=O)c1cccnc1OC1CCN(C(=O)c2ccccc2C)C1
InChIInChI=1S/C20H23N3O3/c1-3-21-18(24)17-9-6-11-22-19(17)26-15-10-12-23(13-15)20(25)16-8-5-4-7-14(16)2/h4-9,11,15H,3,10,12-13H2,1-2H3,(H,21,24)
InChIKeyQRNFCODTTKPIRI-UHFFFAOYSA-N
MW353.42 g/mol
LogP2.43
Rot. Bonds5

About N-ethyl-2-[1-(2-methylbenzoyl)pyrrolidin-3-yl]oxypyridine-3-carboxamide

N-ethyl-2-[1-(2-methylbenzoyl)pyrrolidin-3-yl]oxypyridine-3-carboxamide (PubChem CID 91914015) has the molecular formula C20H23N3O3 and a molecular weight of 353.42 g/mol. Its IUPAC name is N-ethyl-2-[1-(2-methylbenzoyl)pyrrolidin-3-yl]oxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-2-[1-(2-methylbenzoyl)pyrrolidin-3-yl]oxypyridine-3-carboxamide
PubChem CID91914015
Molecular FormulaC20H23N3O3
Molecular Weight353.42 g/mol
Exact Mass353.17
IUPAC NameN-ethyl-2-[1-(2-methylbenzoyl)pyrrolidin-3-yl]oxypyridine-3-carboxamide
SMILESCCNC(=O)c1cccnc1OC1CCN(C(=O)c2ccccc2C)C1
InChIInChI=1S/C20H23N3O3/c1-3-21-18(24)17-9-6-11-22-19(17)26-15-10-12-23(13-15)20(25)16-8-5-4-7-14(16)2/h4-9,11,15H,3,10,12-13H2,1-2H3,(H,21,24)
InChIKeyQRNFCODTTKPIRI-UHFFFAOYSA-N
XLogP2.43
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.42
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[1-(3,5-dimethylbenzoyl)pyrrolidin-3-yl]oxy-N-ethylpyridine-3-carboxamide
CID 91904300
2-[1-(2,5-difluorobenzoyl)pyrrolidin-3-yl]oxy-N-ethylpyridine-3-carboxamide
CID 91914006
[(3S)-3-(3-methoxypyrazin-2-yl)oxypyrrolidin-1-yl]-(2-methyl-3-pyridinyl)methanone
CID 100612049
[2-[1-(2-methoxybenzoyl)pyrrolidin-3-yl]oxy-3-pyridinyl]-piperidin-1-ylmethanone
CID 91904267
3-[1-(2-ethoxypyridine-3-carbonyl)pyrrolidin-3-yl]oxypyrazine-2-carbonitrile
CID 91626812
[(3S)-3-(4,6-dimethylpyrimidin-2-yl)oxypyrrolidin-1-yl]-(2-ethoxy-3-pyridinyl)methanone
CID 129355268
(4-ethoxyphenyl)-[3-[[3-(piperidine-1-carbonyl)-2-pyridinyl]oxy]pyrrolidin-1-yl]methanone
CID 91913913
2-[1-(2-methylbenzoyl)azetidin-3-yl]oxypyridine-3-carbonitrile
CID 122249084
3-[(3R)-1-(2-methylpyridine-3-carbonyl)pyrrolidin-3-yl]oxypyrazine-2-carbonitrile
CID 100755756
[(3R)-3-[(3-bromo-2-pyridinyl)oxy]pyrrolidin-1-yl]-(2-methylsulfanyl-3-pyridinyl)methanone
CID 129417980
3-[[3-(morpholine-4-carbonyl)-2-pyridinyl]oxy]-N-phenylpyrrolidine-1-carboxamide
CID 91904308
(2-methoxy-3-pyridinyl)-[(3R)-3-quinolin-2-yloxypyrrolidin-1-yl]methanone
CID 124727992

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[1-(2-methylbenzoyl)pyrrolidin-3-yl]oxypyridine-3-carboxamide?
The IUPAC name of N-ethyl-2-[1-(2-methylbenzoyl)pyrrolidin-3-yl]oxypyridine-3-carboxamide (CID 91914015) is N-ethyl-2-[1-(2-methylbenzoyl)pyrrolidin-3-yl]oxypyridine-3-carboxamide.
What is the SMILES notation for N-ethyl-2-[1-(2-methylbenzoyl)pyrrolidin-3-yl]oxypyridine-3-carboxamide?
The canonical SMILES for N-ethyl-2-[1-(2-methylbenzoyl)pyrrolidin-3-yl]oxypyridine-3-carboxamide is CCNC(=O)c1cccnc1OC1CCN(C(=O)c2ccccc2C)C1.
What is the InChIKey of N-ethyl-2-[1-(2-methylbenzoyl)pyrrolidin-3-yl]oxypyridine-3-carboxamide?
The InChIKey is QRNFCODTTKPIRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O3/c1-3-21-18(24)17-9-6-11-22-19(17)26-15-10-12-23(13-15)20(25)16-8-5-4-7-14(16)2/h4-9,11,15H,3,10,12-13H2,1-2H3,(H,21,24).
What are the key properties of N-ethyl-2-[1-(2-methylbenzoyl)pyrrolidin-3-yl]oxypyridine-3-carboxamide?
N-ethyl-2-[1-(2-methylbenzoyl)pyrrolidin-3-yl]oxypyridine-3-carboxamide has a molecular weight of 353.42 g/mol, XLogP of 2.43, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[1-(2-methylbenzoyl)pyrrolidin-3-yl]oxypyridine-3-carboxamide is sourced from PubChem (CID 91914015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).