N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-1-methyl-2-oxopyridine-4-carboxamide

C13H15N3O2S — CID 103709177

IUPACN-[(5-ethyl-1,3-thiazol-2-yl)methyl]-1-methyl-2-oxopyridine-4-carboxamide
SMILESCCc1cnc(CNC(=O)c2ccn(C)c(=O)c2)s1
InChIInChI=1S/C13H15N3O2S/c1-3-10-7-14-11(19-10)8-15-13(18)9-4-5-16(2)12(17)6-9/h4-7H,3,8H2,1-2H3,(H,15,18)
InChIKeyXFZUQSVTOJJBJL-UHFFFAOYSA-N
MW277.35 g/mol
LogP1.33
Rot. Bonds4

About N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-1-methyl-2-oxopyridine-4-carboxamide

N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-1-methyl-2-oxopyridine-4-carboxamide (PubChem CID 103709177) 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]-1-methyl-2-oxopyridine-4-carboxamide.

Molecular Properties

Compound NameN-[(5-ethyl-1,3-thiazol-2-yl)methyl]-1-methyl-2-oxopyridine-4-carboxamide
PubChem CID103709177
Molecular FormulaC13H15N3O2S
Molecular Weight277.35 g/mol
Exact Mass277.09
IUPAC NameN-[(5-ethyl-1,3-thiazol-2-yl)methyl]-1-methyl-2-oxopyridine-4-carboxamide
SMILESCCc1cnc(CNC(=O)c2ccn(C)c(=O)c2)s1
InChIInChI=1S/C13H15N3O2S/c1-3-10-7-14-11(19-10)8-15-13(18)9-4-5-16(2)12(17)6-9/h4-7H,3,8H2,1-2H3,(H,15,18)
InChIKeyXFZUQSVTOJJBJL-UHFFFAOYSA-N
XLogP1.33
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.35
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N,2-dimethyl-N-[2-(5-methyl-1,3-thiazol-2-yl)ethyl]-6-oxo-1H-pyridine-3-carboxamide
CID 75389323
1-[2-(5-Ethyl-1,3-thiazol-2-yl)ethyl]-3-(1-methyl-2-oxo-3-pyridinyl)urea
CID 72117534
1-methyl-2-oxo-N-(1,3-thiazol-2-ylmethyl)pyridine-4-carboxamide
CID 75461584
(2E,4E)-2-ethenyl-4-fluoro-N-[2-(2-methyl-1,3-thiazol-5-yl)ethyl]hexa-2,4-dienamide
CID 143454822
N-[(2-methyl-1,3-thiazol-5-yl)methyl]-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide
CID 86836187
5-Fluoro-1-[(5-methyl-1,3-thiazol-2-yl)methyl]pyridin-2-one
CID 100678564
3-methyl-5-[2-(trifluoromethyl)-1,3-thiazol-5-yl]-1H-pyridin-2-one
CID 113876886
N-[2-(5-methyl-1,3-thiazol-2-yl)propan-2-yl]-6-oxo-5-(trifluoromethyl)-1H-pyridine-3-carboxamide
CID 138026456
(2E,4Z)-6-[2-[(3E,5E)-5-fluorohepta-1,3,5-trien-3-yl]-1,3-thiazol-5-yl]-N,2-dimethylhepta-2,4,6-trienamide
CID 144304118
3-(5-propan-2-yl-1,3-thiazol-2-yl)-1H-pyridin-2-one
CID 178687090
N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]-6-oxo-1H-pyridine-3-carboxamide
CID 56814379
N-[(2-methyl-1,3-thiazol-5-yl)methyl]-6-oxo-1H-pyridine-3-carboxamide
CID 61280072

Frequently Asked Questions

What is the IUPAC name of N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-1-methyl-2-oxopyridine-4-carboxamide?
The IUPAC name of N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-1-methyl-2-oxopyridine-4-carboxamide (CID 103709177) is N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-1-methyl-2-oxopyridine-4-carboxamide.
What is the SMILES notation for N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-1-methyl-2-oxopyridine-4-carboxamide?
The canonical SMILES for N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-1-methyl-2-oxopyridine-4-carboxamide is CCc1cnc(CNC(=O)c2ccn(C)c(=O)c2)s1.
What is the InChIKey of N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-1-methyl-2-oxopyridine-4-carboxamide?
The InChIKey is XFZUQSVTOJJBJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2S/c1-3-10-7-14-11(19-10)8-15-13(18)9-4-5-16(2)12(17)6-9/h4-7H,3,8H2,1-2H3,(H,15,18).
What are the key properties of N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-1-methyl-2-oxopyridine-4-carboxamide?
N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-1-methyl-2-oxopyridine-4-carboxamide has a molecular weight of 277.35 g/mol, XLogP of 1.33, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-1-methyl-2-oxopyridine-4-carboxamide is sourced from PubChem (CID 103709177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).