N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide

C13H15N3O2S — CID 103718320

IUPACN-[(5-ethyl-1,3-thiazol-2-yl)methyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide
SMILESCCc1cnc(CNC(=O)c2c[nH]c(C)cc2=O)s1
InChIInChI=1S/C13H15N3O2S/c1-3-9-5-15-12(19-9)7-16-13(18)10-6-14-8(2)4-11(10)17/h4-6H,3,7H2,1-2H3,(H,14,17)(H,16,18)
InChIKeyVWWZNUOGMMRQBF-UHFFFAOYSA-N
MW277.35 g/mol
LogP1.63
Rot. Bonds4

About N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide

N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide (PubChem CID 103718320) has the molecular formula C13H15N3O2S and a molecular weight of 277.35 g/mol. Its IUPAC name is N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(5-ethyl-1,3-thiazol-2-yl)methyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide
PubChem CID103718320
Molecular FormulaC13H15N3O2S
Molecular Weight277.35 g/mol
Exact Mass277.09
IUPAC NameN-[(5-ethyl-1,3-thiazol-2-yl)methyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide
SMILESCCc1cnc(CNC(=O)c2c[nH]c(C)cc2=O)s1
InChIInChI=1S/C13H15N3O2S/c1-3-9-5-15-12(19-9)7-16-13(18)10-6-14-8(2)4-11(10)17/h4-6H,3,7H2,1-2H3,(H,14,17)(H,16,18)
InChIKeyVWWZNUOGMMRQBF-UHFFFAOYSA-N
XLogP1.63
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.35
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-1,6-dimethyl-4-oxo-1,4-dihydropyridine-3-carboxamide
CID 121512746
N-[2-(5-methyl-1,3-thiazol-2-yl)propan-2-yl]-6-oxo-5-(trifluoromethyl)-1H-pyridine-3-carboxamide
CID 138026456
5-Acetyl-2-acetylaminomethylthiazole
CID 10241840
2,2-dimethyl-N-[[6-methyl-4-oxo-2-(1,3-thiazol-2-yl)-1H-pyridin-3-yl]methyl]propanamide
CID 118544297
N-[[6-methyl-4-oxo-2-(1,3-thiazol-2-yl)-1H-pyridin-3-yl]methyl]acetamide
CID 118544403
N-[1-(5-acetyl-1,3-thiazol-2-yl)ethyl]-2-ethenylimino-4-methylpent-3-enamide
CID 139564934
ethane;N-[[6-methyl-4-oxo-2-(1,3-thiazol-2-yl)-1H-pyridin-3-yl]methyl]acetamide
CID 144654887
5-chloro-N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide
CID 71913866
N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-ethyl-1,3-thiazole-5-carboxamide
CID 72047098
4-oxo-N-[1-(1,3-thiazol-2-yl)ethyl]-1H-pyridine-3-carboxamide
CID 103337486
6-methyl-4-oxo-N-(1,3-thiazol-2-ylmethyl)-1H-pyridine-3-carboxamide
CID 103696390
N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-1-methyl-2-oxopyridine-4-carboxamide
CID 103709177

Frequently Asked Questions

What is the IUPAC name of N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide (CID 103718320) is N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide is CCc1cnc(CNC(=O)c2c[nH]c(C)cc2=O)s1.
What is the InChIKey of N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide?
The InChIKey is VWWZNUOGMMRQBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2S/c1-3-9-5-15-12(19-9)7-16-13(18)10-6-14-8(2)4-11(10)17/h4-6H,3,7H2,1-2H3,(H,14,17)(H,16,18).
What are the key properties of N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide?
N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide has a molecular weight of 277.35 g/mol, XLogP of 1.63, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 103718320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).