2-(ethylamino)-6-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]pyridine-4-carboxamide

C13H16N4O2S — CID 106383412

IUPAC2-(ethylamino)-6-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]pyridine-4-carboxamide
SMILESCCNc1cc(C(=O)NCc2csc(=O)[nH]2)cc(C)n1
InChIInChI=1S/C13H16N4O2S/c1-3-14-11-5-9(4-8(2)16-11)12(18)15-6-10-7-20-13(19)17-10/h4-5,7H,3,6H2,1-2H3,(H,14,16)(H,15,18)(H,17,19)
InChIKeyZYBVTMZDTBMNEJ-UHFFFAOYSA-N
MW292.36 g/mol
LogP1.50
Rot. Bonds5

About 2-(ethylamino)-6-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]pyridine-4-carboxamide

2-(ethylamino)-6-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]pyridine-4-carboxamide (PubChem CID 106383412) has the molecular formula C13H16N4O2S and a molecular weight of 292.36 g/mol. Its IUPAC name is 2-(ethylamino)-6-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(ethylamino)-6-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]pyridine-4-carboxamide
PubChem CID106383412
Molecular FormulaC13H16N4O2S
Molecular Weight292.36 g/mol
Exact Mass292.10
IUPAC Name2-(ethylamino)-6-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]pyridine-4-carboxamide
SMILESCCNc1cc(C(=O)NCc2csc(=O)[nH]2)cc(C)n1
InChIInChI=1S/C13H16N4O2S/c1-3-14-11-5-9(4-8(2)16-11)12(18)15-6-10-7-20-13(19)17-10/h4-5,7H,3,6H2,1-2H3,(H,14,16)(H,15,18)(H,17,19)
InChIKeyZYBVTMZDTBMNEJ-UHFFFAOYSA-N
XLogP1.50
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.36
LogP ≤ 51.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]-6-propylpyridine-4-carboxamide
CID 106383344
2-(ethylamino)-5-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]benzamide
CID 106383389
2-(ethylamino)-6-methyl-N-(pyridazin-3-ylmethyl)pyridine-4-carboxamide
CID 106897686
2-(ethylamino)-6-methyl-N-(1,2,4-oxadiazol-3-ylmethyl)pyridine-4-carboxamide
CID 106408556
2-(ethylamino)-6-methyl-N-[(4-methyl-3-pyridinyl)methyl]pyridine-4-carboxamide
CID 114957522
2,3-dimethyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]-1H-indole-5-carboxamide
CID 103775042
4-(methylamino)-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]benzamide
CID 106383401
N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]propanamide
CID 103775054
4-bromo-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]benzamide
CID 103775053
2-amino-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]pyridine-4-carboxamide
CID 114181779
2-(1-aminoethyl)-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]-1,3-thiazole-4-carboxamide
CID 106381203
3-chloro-4-hydroxy-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]benzamide
CID 103862828

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-6-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]pyridine-4-carboxamide?
The IUPAC name of 2-(ethylamino)-6-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]pyridine-4-carboxamide (CID 106383412) is 2-(ethylamino)-6-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]pyridine-4-carboxamide.
What is the SMILES notation for 2-(ethylamino)-6-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]pyridine-4-carboxamide?
The canonical SMILES for 2-(ethylamino)-6-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]pyridine-4-carboxamide is CCNc1cc(C(=O)NCc2csc(=O)[nH]2)cc(C)n1.
What is the InChIKey of 2-(ethylamino)-6-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]pyridine-4-carboxamide?
The InChIKey is ZYBVTMZDTBMNEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O2S/c1-3-14-11-5-9(4-8(2)16-11)12(18)15-6-10-7-20-13(19)17-10/h4-5,7H,3,6H2,1-2H3,(H,14,16)(H,15,18)(H,17,19).
What are the key properties of 2-(ethylamino)-6-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]pyridine-4-carboxamide?
2-(ethylamino)-6-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]pyridine-4-carboxamide has a molecular weight of 292.36 g/mol, XLogP of 1.50, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-6-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]pyridine-4-carboxamide is sourced from PubChem (CID 106383412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).