3-[(2-ethyl-3-pyridinyl)oxy]-5-pyridin-2-ylsulfanylpyridine-2-carboxamide

C18H16N4O2S — CID 67486144

IUPAC3-[(2-ethyl-3-pyridinyl)oxy]-5-pyridin-2-ylsulfanylpyridine-2-carboxamide
SMILESCCc1ncccc1Oc1cc(Sc2ccccn2)cnc1C(N)=O
InChIInChI=1S/C18H16N4O2S/c1-2-13-14(6-5-9-20-13)24-15-10-12(11-22-17(15)18(19)23)25-16-7-3-4-8-21-16/h3-11H,2H2,1H3,(H2,19,23)
InChIKeyNHBNXQZNKCJDGI-UHFFFAOYSA-N
MW352.42 g/mol
LogP3.48
Rot. Bonds6

About 3-[(2-ethyl-3-pyridinyl)oxy]-5-pyridin-2-ylsulfanylpyridine-2-carboxamide

3-[(2-ethyl-3-pyridinyl)oxy]-5-pyridin-2-ylsulfanylpyridine-2-carboxamide (PubChem CID 67486144) has the molecular formula C18H16N4O2S and a molecular weight of 352.42 g/mol. Its IUPAC name is 3-[(2-ethyl-3-pyridinyl)oxy]-5-pyridin-2-ylsulfanylpyridine-2-carboxamide.

Molecular Properties

Compound Name3-[(2-ethyl-3-pyridinyl)oxy]-5-pyridin-2-ylsulfanylpyridine-2-carboxamide
PubChem CID67486144
Molecular FormulaC18H16N4O2S
Molecular Weight352.42 g/mol
Exact Mass352.10
IUPAC Name3-[(2-ethyl-3-pyridinyl)oxy]-5-pyridin-2-ylsulfanylpyridine-2-carboxamide
SMILESCCc1ncccc1Oc1cc(Sc2ccccn2)cnc1C(N)=O
InChIInChI=1S/C18H16N4O2S/c1-2-13-14(6-5-9-20-13)24-15-10-12(11-22-17(15)18(19)23)25-16-7-3-4-8-21-16/h3-11H,2H2,1H3,(H2,19,23)
InChIKeyNHBNXQZNKCJDGI-UHFFFAOYSA-N
XLogP3.48
TPSA90.99 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.42
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 3-[(2-ethyl-3-pyridinyl)oxy]-5-pyridin-2-ylsulfanylpyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[(2,4-dimethyl-3-pyridinyl)oxy]-5-pyridin-2-ylsulfanylpyridine-2-carboxamide
CID 67486298
3-[(2-methyl-3-pyridinyl)oxy]-5-pyridin-2-ylsulfanylpyridine-2-carbonitrile
CID 67485792
2-(4-ethyl-3-methylphenyl)sulfanylpyridine
CID 71179430
2-methoxy-1-[4-[5-[[3-[(2-methyl-3-pyridinyl)oxy]-5-pyridin-2-ylsulfanyl-2-pyridinyl]amino]-1,2,4-thiadiazol-3-yl]piperidin-1-yl]ethanone;dihydrochloride
CID 68710758
ethyl 5-amino-2-pyridin-2-ylsulfanylpyridine-4-carboxylate
CID 114090847
ethyl N-(4-pyridin-2-ylsulfanylanilino)carbamate
CID 155908054
3-(2-ethylphenyl)pyridine-2-carboxamide
CID 174881246
1-[2-[[3-[(2-methyl-3-pyridinyl)oxy]-5-pyridin-2-ylsulfanyl-2-pyridinyl]amino]-1,3-thiazol-4-yl]propane-1,2-diol
CID 59443647
ethane;2-ethyl-3-methoxypyridine
CID 144504427
2,2-dimethyl-1-[2-[[3-[(2-methyl-3-pyridinyl)oxy]-5-pyridin-2-ylsulfanyl-2-pyridinyl]amino]-1,3-thiazol-4-yl]propane-1,3-diol
CID 59443673
1-[3-[5-[[3-[(2-ethyl-3-pyridinyl)oxy]-5-(2-methoxyethylsulfanyl)-2-pyridinyl]amino]-1,2,4-thiadiazol-3-yl]-8-azabicyclo[3.2.1]octan-8-yl]ethanone
CID 59291611
[3-[(2-ethyl-6-methyl-3-pyridinyl)oxy]-2-pyridinyl]methanamine
CID 103174319

Frequently Asked Questions

What is the IUPAC name of 3-[(2-ethyl-3-pyridinyl)oxy]-5-pyridin-2-ylsulfanylpyridine-2-carboxamide?
The IUPAC name of 3-[(2-ethyl-3-pyridinyl)oxy]-5-pyridin-2-ylsulfanylpyridine-2-carboxamide (CID 67486144) is 3-[(2-ethyl-3-pyridinyl)oxy]-5-pyridin-2-ylsulfanylpyridine-2-carboxamide.
What is the SMILES notation for 3-[(2-ethyl-3-pyridinyl)oxy]-5-pyridin-2-ylsulfanylpyridine-2-carboxamide?
The canonical SMILES for 3-[(2-ethyl-3-pyridinyl)oxy]-5-pyridin-2-ylsulfanylpyridine-2-carboxamide is CCc1ncccc1Oc1cc(Sc2ccccn2)cnc1C(N)=O.
What is the InChIKey of 3-[(2-ethyl-3-pyridinyl)oxy]-5-pyridin-2-ylsulfanylpyridine-2-carboxamide?
The InChIKey is NHBNXQZNKCJDGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N4O2S/c1-2-13-14(6-5-9-20-13)24-15-10-12(11-22-17(15)18(19)23)25-16-7-3-4-8-21-16/h3-11H,2H2,1H3,(H2,19,23).
What are the key properties of 3-[(2-ethyl-3-pyridinyl)oxy]-5-pyridin-2-ylsulfanylpyridine-2-carboxamide?
3-[(2-ethyl-3-pyridinyl)oxy]-5-pyridin-2-ylsulfanylpyridine-2-carboxamide has a molecular weight of 352.42 g/mol, XLogP of 3.48, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-ethyl-3-pyridinyl)oxy]-5-pyridin-2-ylsulfanylpyridine-2-carboxamide is sourced from PubChem (CID 67486144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).