4-ethylsulfanyl-N-(2-methoxyphenyl)-6-oxo-1H-pyridine-3-carboxamide

C15H16N2O3S — CID 132918685

IUPAC4-ethylsulfanyl-N-(2-methoxyphenyl)-6-oxo-1H-pyridine-3-carboxamide
SMILESCCSc1cc(=O)[nH]cc1C(=O)Nc1ccccc1OC
InChIInChI=1S/C15H16N2O3S/c1-3-21-13-8-14(18)16-9-10(13)15(19)17-11-6-4-5-7-12(11)20-2/h4-9H,3H2,1-2H3,(H,16,18)(H,17,19)
InChIKeyTVXBUVLDFDLVNO-UHFFFAOYSA-N
MW304.37 g/mol
LogP2.75
Rot. Bonds5

About 4-ethylsulfanyl-N-(2-methoxyphenyl)-6-oxo-1H-pyridine-3-carboxamide

4-ethylsulfanyl-N-(2-methoxyphenyl)-6-oxo-1H-pyridine-3-carboxamide (PubChem CID 132918685) has the molecular formula C15H16N2O3S and a molecular weight of 304.37 g/mol. Its IUPAC name is 4-ethylsulfanyl-N-(2-methoxyphenyl)-6-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name4-ethylsulfanyl-N-(2-methoxyphenyl)-6-oxo-1H-pyridine-3-carboxamide
PubChem CID132918685
Molecular FormulaC15H16N2O3S
Molecular Weight304.37 g/mol
Exact Mass304.09
IUPAC Name4-ethylsulfanyl-N-(2-methoxyphenyl)-6-oxo-1H-pyridine-3-carboxamide
SMILESCCSc1cc(=O)[nH]cc1C(=O)Nc1ccccc1OC
InChIInChI=1S/C15H16N2O3S/c1-3-21-13-8-14(18)16-9-10(13)15(19)17-11-6-4-5-7-12(11)20-2/h4-9H,3H2,1-2H3,(H,16,18)(H,17,19)
InChIKeyTVXBUVLDFDLVNO-UHFFFAOYSA-N
XLogP2.75
TPSA71.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.37
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 92646111
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6-amino-N-(2-methoxyphenyl)-1H-indole-3-carboxamide
CID 61089726
5,7-difluoro-N-(2-methoxyphenyl)-4-oxo-1H-quinoline-3-carboxamide
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3-(4-ethoxyphenyl)-N-(2-methoxyphenyl)-2,4-dioxo-1H-pyrimidine-5-carboxamide
CID 3408404
5,6-dimethoxy-N-(2-propan-2-yloxyphenyl)-1H-indole-3-carboxamide
CID 113206991
N-(2-ethylsulfanylphenyl)-2-iodobenzamide
CID 47310864
2-(difluoromethylsulfanyl)-N-(2-methoxyphenyl)benzamide
CID 17424318
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2-bromo-N-(2-methoxyphenyl)benzamide
CID 676344

Frequently Asked Questions

What is the IUPAC name of 4-ethylsulfanyl-N-(2-methoxyphenyl)-6-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of 4-ethylsulfanyl-N-(2-methoxyphenyl)-6-oxo-1H-pyridine-3-carboxamide (CID 132918685) is 4-ethylsulfanyl-N-(2-methoxyphenyl)-6-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for 4-ethylsulfanyl-N-(2-methoxyphenyl)-6-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for 4-ethylsulfanyl-N-(2-methoxyphenyl)-6-oxo-1H-pyridine-3-carboxamide is CCSc1cc(=O)[nH]cc1C(=O)Nc1ccccc1OC.
What is the InChIKey of 4-ethylsulfanyl-N-(2-methoxyphenyl)-6-oxo-1H-pyridine-3-carboxamide?
The InChIKey is TVXBUVLDFDLVNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3S/c1-3-21-13-8-14(18)16-9-10(13)15(19)17-11-6-4-5-7-12(11)20-2/h4-9H,3H2,1-2H3,(H,16,18)(H,17,19).
What are the key properties of 4-ethylsulfanyl-N-(2-methoxyphenyl)-6-oxo-1H-pyridine-3-carboxamide?
4-ethylsulfanyl-N-(2-methoxyphenyl)-6-oxo-1H-pyridine-3-carboxamide has a molecular weight of 304.37 g/mol, XLogP of 2.75, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethylsulfanyl-N-(2-methoxyphenyl)-6-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 132918685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).