4-(ethylamino)-6-methyl-N-(4-methylsulfanylphenyl)pyridine-3-carboxamide

C16H19N3OS — CID 81237833

IUPAC4-(ethylamino)-6-methyl-N-(4-methylsulfanylphenyl)pyridine-3-carboxamide
SMILESCCNc1cc(C)ncc1C(=O)Nc1ccc(SC)cc1
InChIInChI=1S/C16H19N3OS/c1-4-17-15-9-11(2)18-10-14(15)16(20)19-12-5-7-13(21-3)8-6-12/h5-10H,4H2,1-3H3,(H,17,18)(H,19,20)
InChIKeyTWFWYIANQHCYFY-UHFFFAOYSA-N
MW301.42 g/mol
LogP3.80
Rot. Bonds5

About 4-(ethylamino)-6-methyl-N-(4-methylsulfanylphenyl)pyridine-3-carboxamide

4-(ethylamino)-6-methyl-N-(4-methylsulfanylphenyl)pyridine-3-carboxamide (PubChem CID 81237833) has the molecular formula C16H19N3OS and a molecular weight of 301.42 g/mol. Its IUPAC name is 4-(ethylamino)-6-methyl-N-(4-methylsulfanylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name4-(ethylamino)-6-methyl-N-(4-methylsulfanylphenyl)pyridine-3-carboxamide
PubChem CID81237833
Molecular FormulaC16H19N3OS
Molecular Weight301.42 g/mol
Exact Mass301.12
IUPAC Name4-(ethylamino)-6-methyl-N-(4-methylsulfanylphenyl)pyridine-3-carboxamide
SMILESCCNc1cc(C)ncc1C(=O)Nc1ccc(SC)cc1
InChIInChI=1S/C16H19N3OS/c1-4-17-15-9-11(2)18-10-14(15)16(20)19-12-5-7-13(21-3)8-6-12/h5-10H,4H2,1-3H3,(H,17,18)(H,19,20)
InChIKeyTWFWYIANQHCYFY-UHFFFAOYSA-N
XLogP3.80
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.42
LogP ≤ 53.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-cyanophenyl)-4-(ethylamino)-6-methylpyridine-3-carboxamide
CID 81239209
N-(4-bromo-3-fluorophenyl)-4-(ethylamino)-6-methylpyridine-3-carboxamide
CID 81234726
4-(ethylamino)-6-methyl-N-pyridin-3-ylpyridine-3-carboxamide
CID 81235839
N-(2,6-dimethylphenyl)-4-(ethylamino)-6-methylpyridine-3-carboxamide
CID 81237854
4-(ethylamino)-N-(2-fluoro-4-methylphenyl)-6-methylpyridine-3-carboxamide
CID 81238867
N-(4-chlorophenyl)-6-methyl-4-(propylamino)pyridine-3-carboxamide
CID 81238211
4-(ethylamino)-6-methyl-N-pyridin-2-ylpyridine-3-carboxamide
CID 81236954
4-(ethylamino)-3-methyl-N-(4-methylsulfanylphenyl)benzamide
CID 63209394
4-(ethylamino)-6-methyl-N-(3-methyl-2-pyridinyl)pyridine-3-carboxamide
CID 81234677
N-(4-ethylphenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide
CID 81256559
4-(ethylamino)-6-methyl-N-propylpyridine-3-carboxamide
CID 81236373
4-(ethylamino)-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-6-methylpyridine-3-carboxamide
CID 81238640

Frequently Asked Questions

What is the IUPAC name of 4-(ethylamino)-6-methyl-N-(4-methylsulfanylphenyl)pyridine-3-carboxamide?
The IUPAC name of 4-(ethylamino)-6-methyl-N-(4-methylsulfanylphenyl)pyridine-3-carboxamide (CID 81237833) is 4-(ethylamino)-6-methyl-N-(4-methylsulfanylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 4-(ethylamino)-6-methyl-N-(4-methylsulfanylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 4-(ethylamino)-6-methyl-N-(4-methylsulfanylphenyl)pyridine-3-carboxamide is CCNc1cc(C)ncc1C(=O)Nc1ccc(SC)cc1.
What is the InChIKey of 4-(ethylamino)-6-methyl-N-(4-methylsulfanylphenyl)pyridine-3-carboxamide?
The InChIKey is TWFWYIANQHCYFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3OS/c1-4-17-15-9-11(2)18-10-14(15)16(20)19-12-5-7-13(21-3)8-6-12/h5-10H,4H2,1-3H3,(H,17,18)(H,19,20).
What are the key properties of 4-(ethylamino)-6-methyl-N-(4-methylsulfanylphenyl)pyridine-3-carboxamide?
4-(ethylamino)-6-methyl-N-(4-methylsulfanylphenyl)pyridine-3-carboxamide has a molecular weight of 301.42 g/mol, XLogP of 3.80, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(ethylamino)-6-methyl-N-(4-methylsulfanylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 81237833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).