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

C12H13N3O2S — CID 103718295

IUPAC6-methyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]-4-oxo-1H-pyridine-3-carboxamide
SMILESCc1cc(=O)c(C(=O)NCc2ncc(C)s2)c[nH]1
InChIInChI=1S/C12H13N3O2S/c1-7-3-10(16)9(5-13-7)12(17)15-6-11-14-4-8(2)18-11/h3-5H,6H2,1-2H3,(H,13,16)(H,15,17)
InChIKeyUNJUFWKTFKDLKS-UHFFFAOYSA-N
MW263.32 g/mol
LogP1.38
Rot. Bonds3

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

6-methyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]-4-oxo-1H-pyridine-3-carboxamide (PubChem CID 103718295) has the molecular formula C12H13N3O2S and a molecular weight of 263.32 g/mol. Its IUPAC name is 6-methyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]-4-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name6-methyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]-4-oxo-1H-pyridine-3-carboxamide
PubChem CID103718295
Molecular FormulaC12H13N3O2S
Molecular Weight263.32 g/mol
Exact Mass263.07
IUPAC Name6-methyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]-4-oxo-1H-pyridine-3-carboxamide
SMILESCc1cc(=O)c(C(=O)NCc2ncc(C)s2)c[nH]1
InChIInChI=1S/C12H13N3O2S/c1-7-3-10(16)9(5-13-7)12(17)15-6-11-14-4-8(2)18-11/h3-5H,6H2,1-2H3,(H,13,16)(H,15,17)
InChIKeyUNJUFWKTFKDLKS-UHFFFAOYSA-N
XLogP1.38
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.32
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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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
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
2,2-dimethyl-N-[[6-methyl-4-oxo-2-(1,3-thiazol-2-yl)-1H-pyridin-3-yl]methyl]propanamide
CID 118544297
2,2-dimethyl-N-[[6-methyl-4-oxo-2-(1,3-thiazol-5-yl)-1H-pyridin-3-yl]methyl]propanamide
CID 118544308
N-[[6-methyl-4-oxo-2-(1,3-thiazol-2-yl)-1H-pyridin-3-yl]methyl]acetamide
CID 118544403
N-[[6-methyl-4-oxo-2-(1,3-thiazol-5-yl)-1H-pyridin-3-yl]methyl]acetamide
CID 118544444
N-[[6-methyl-4-oxo-2-(1,3-thiazol-2-yl)-1H-pyridin-3-yl]methyl]carbamoyl iodide
CID 132022171
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-5-yl)-1H-pyridin-3-yl]methyl]acetamide
CID 144654841
ethane;N-[[6-methyl-4-oxo-2-(1,3-thiazol-2-yl)-1H-pyridin-3-yl]methyl]acetamide
CID 144654887
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 6-methyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]-4-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of 6-methyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]-4-oxo-1H-pyridine-3-carboxamide (CID 103718295) is 6-methyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]-4-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for 6-methyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]-4-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for 6-methyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]-4-oxo-1H-pyridine-3-carboxamide is Cc1cc(=O)c(C(=O)NCc2ncc(C)s2)c[nH]1.
What is the InChIKey of 6-methyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]-4-oxo-1H-pyridine-3-carboxamide?
The InChIKey is UNJUFWKTFKDLKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O2S/c1-7-3-10(16)9(5-13-7)12(17)15-6-11-14-4-8(2)18-11/h3-5H,6H2,1-2H3,(H,13,16)(H,15,17).
What are the key properties of 6-methyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]-4-oxo-1H-pyridine-3-carboxamide?
6-methyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]-4-oxo-1H-pyridine-3-carboxamide has a molecular weight of 263.32 g/mol, XLogP of 1.38, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]-4-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 103718295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).