3-(4-methyl-1,3-thiazol-2-yl)-1H-pyridin-2-one

C9H8N2OS — CID 155787529

IUPAC3-(4-methyl-1,3-thiazol-2-yl)-1H-pyridin-2-one
SMILESCc1csc(-c2ccc[nH]c2=O)n1
InChIInChI=1S/C9H8N2OS/c1-6-5-13-9(11-6)7-3-2-4-10-8(7)12/h2-5H,1H3,(H,10,12)
InChIKeyHTWYBJHIYWZHAG-UHFFFAOYSA-N
MW192.24 g/mol
LogP1.81
Rot. Bonds1

About 3-(4-methyl-1,3-thiazol-2-yl)-1H-pyridin-2-one

3-(4-methyl-1,3-thiazol-2-yl)-1H-pyridin-2-one (PubChem CID 155787529) has the molecular formula C9H8N2OS and a molecular weight of 192.24 g/mol. Its IUPAC name is 3-(4-methyl-1,3-thiazol-2-yl)-1H-pyridin-2-one.

Molecular Properties

Compound Name3-(4-methyl-1,3-thiazol-2-yl)-1H-pyridin-2-one
PubChem CID155787529
Molecular FormulaC9H8N2OS
Molecular Weight192.24 g/mol
Exact Mass192.04
IUPAC Name3-(4-methyl-1,3-thiazol-2-yl)-1H-pyridin-2-one
SMILESCc1csc(-c2ccc[nH]c2=O)n1
InChIInChI=1S/C9H8N2OS/c1-6-5-13-9(11-6)7-3-2-4-10-8(7)12/h2-5H,1H3,(H,10,12)
InChIKeyHTWYBJHIYWZHAG-UHFFFAOYSA-N
XLogP1.81
TPSA45.75 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.24
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(2-tert-butyl-1,3-thiazol-4-yl)methyl]-N-methyl-6-oxopyridine-3-carboxamide
CID 47073248
N,6-dimethyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]-2-oxo-1H-pyridine-3-carboxamide
CID 72046894
3-[4-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,4-diazepane-1-carbonyl]-1H-pyridin-2-one
CID 72144042
N-[(2-ethyl-1,3-thiazol-4-yl)methyl]-N-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 47076981
6-methyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]-2-oxo-1H-pyridine-3-carboxamide
CID 72049082
1-(5-methyl-6-oxo-1H-pyridin-3-yl)-3-[(2S)-2-(4-methyl-1,3-thiazol-2-yl)propyl]urea
CID 97826417
1-methyl-N-[(1S)-1-(2-methyl-1,3-thiazol-4-yl)ethyl]-2-oxopyridine-3-carboxamide
CID 124292028
1-Ethyl-3-[(2-methyl-1,3-thiazol-4-yl)methylamino]pyridin-2-one
CID 132312673
N-[(4-methyl-1,3-thiazol-2-yl)methyl]-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide
CID 36432940
N-methyl-2-sulfanylidene-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]-1H-pyridine-3-carboxamide
CID 71983783
6-methyl-2-oxo-N-[1-[4-(trifluoromethyl)-1,3-thiazol-2-yl]propyl]-1H-pyridine-3-carboxamide
CID 71985929
2-sulfanylidene-N-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]-1H-pyridine-3-carboxamide
CID 71993346

Frequently Asked Questions

What is the IUPAC name of 3-(4-methyl-1,3-thiazol-2-yl)-1H-pyridin-2-one?
The IUPAC name of 3-(4-methyl-1,3-thiazol-2-yl)-1H-pyridin-2-one (CID 155787529) is 3-(4-methyl-1,3-thiazol-2-yl)-1H-pyridin-2-one.
What is the SMILES notation for 3-(4-methyl-1,3-thiazol-2-yl)-1H-pyridin-2-one?
The canonical SMILES for 3-(4-methyl-1,3-thiazol-2-yl)-1H-pyridin-2-one is Cc1csc(-c2ccc[nH]c2=O)n1.
What is the InChIKey of 3-(4-methyl-1,3-thiazol-2-yl)-1H-pyridin-2-one?
The InChIKey is HTWYBJHIYWZHAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2OS/c1-6-5-13-9(11-6)7-3-2-4-10-8(7)12/h2-5H,1H3,(H,10,12).
What are the key properties of 3-(4-methyl-1,3-thiazol-2-yl)-1H-pyridin-2-one?
3-(4-methyl-1,3-thiazol-2-yl)-1H-pyridin-2-one has a molecular weight of 192.24 g/mol, XLogP of 1.81, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methyl-1,3-thiazol-2-yl)-1H-pyridin-2-one is sourced from PubChem (CID 155787529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).