1-methyl-N-(4-methyl-1,3-thiazol-2-yl)-6-oxopyridazine-3-carboxamide

C10H10N4O2S — CID 2110480

IUPAC1-methyl-N-(4-methyl-1,3-thiazol-2-yl)-6-oxopyridazine-3-carboxamide
SMILESCc1csc(NC(=O)c2ccc(=O)n(C)n2)n1
InChIInChI=1S/C10H10N4O2S/c1-6-5-17-10(11-6)12-9(16)7-3-4-8(15)14(2)13-7/h3-5H,1-2H3,(H,11,12,16)
InChIKeyLBQYGDCFOWJTOX-UHFFFAOYSA-N
MW250.28 g/mol
LogP0.80
Rot. Bonds2

About 1-methyl-N-(4-methyl-1,3-thiazol-2-yl)-6-oxopyridazine-3-carboxamide

1-methyl-N-(4-methyl-1,3-thiazol-2-yl)-6-oxopyridazine-3-carboxamide (PubChem CID 2110480) has the molecular formula C10H10N4O2S and a molecular weight of 250.28 g/mol. Its IUPAC name is 1-methyl-N-(4-methyl-1,3-thiazol-2-yl)-6-oxopyridazine-3-carboxamide.

Molecular Properties

Compound Name1-methyl-N-(4-methyl-1,3-thiazol-2-yl)-6-oxopyridazine-3-carboxamide
PubChem CID2110480
Molecular FormulaC10H10N4O2S
Molecular Weight250.28 g/mol
Exact Mass250.05
IUPAC Name1-methyl-N-(4-methyl-1,3-thiazol-2-yl)-6-oxopyridazine-3-carboxamide
SMILESCc1csc(NC(=O)c2ccc(=O)n(C)n2)n1
InChIInChI=1S/C10H10N4O2S/c1-6-5-17-10(11-6)12-9(16)7-3-4-8(15)14(2)13-7/h3-5H,1-2H3,(H,11,12,16)
InChIKeyLBQYGDCFOWJTOX-UHFFFAOYSA-N
XLogP0.80
TPSA76.88 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.28
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(4-methyl-1,3-thiazol-2-yl)-6-oxo-1H-pyridine-3-carboxamide
CID 2474878
2-(3-methyl-6-oxopyridazin-1(6H)-yl)-N-(4-methylthiazol-2-yl)acetamide
CID 49704598
1-methyl-6-oxo-N-(1,3-thiazol-2-yl)pyridazine-3-carboxamide
CID 8762618
Ethyl 2-(2-(1-methyl-6-oxo-1,6-dihydropyridazine-3-carboxamido)thiazol-4-yl)acetate
CID 16602620
2-((4-ethyl-6-oxo-1,6-dihydropyrimidin-2-yl)thio)-N-(4-methylthiazol-2-yl)acetamide
CID 135561553
N-[4-(2-amino-2-oxoethyl)-1,3-thiazol-2-yl]-1-methyl-6-oxopyridazine-3-carboxamide
CID 24598783
6-oxo-1-propyl-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyridazine-3-carboxamide
CID 43068601
6-oxo-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]-1H-pyridazine-3-carboxamide
CID 43069892
N-[4-[[6-oxo-3-(trifluoromethyl)pyridazin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide
CID 75388794
1-methyl-6-oxo-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyridazine-3-carboxamide
CID 86980075
N-(4-methylthiazol-2-yl)-6-oxo-1,6-dihydropyridazine-3-carboxamide
CID 7585559
N-(4-methylthiazol-2-yl)-2-(6-oxopyridazin-1(6H)-yl)acetamide
CID 45497095

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(4-methyl-1,3-thiazol-2-yl)-6-oxopyridazine-3-carboxamide?
The IUPAC name of 1-methyl-N-(4-methyl-1,3-thiazol-2-yl)-6-oxopyridazine-3-carboxamide (CID 2110480) is 1-methyl-N-(4-methyl-1,3-thiazol-2-yl)-6-oxopyridazine-3-carboxamide.
What is the SMILES notation for 1-methyl-N-(4-methyl-1,3-thiazol-2-yl)-6-oxopyridazine-3-carboxamide?
The canonical SMILES for 1-methyl-N-(4-methyl-1,3-thiazol-2-yl)-6-oxopyridazine-3-carboxamide is Cc1csc(NC(=O)c2ccc(=O)n(C)n2)n1.
What is the InChIKey of 1-methyl-N-(4-methyl-1,3-thiazol-2-yl)-6-oxopyridazine-3-carboxamide?
The InChIKey is LBQYGDCFOWJTOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O2S/c1-6-5-17-10(11-6)12-9(16)7-3-4-8(15)14(2)13-7/h3-5H,1-2H3,(H,11,12,16).
What are the key properties of 1-methyl-N-(4-methyl-1,3-thiazol-2-yl)-6-oxopyridazine-3-carboxamide?
1-methyl-N-(4-methyl-1,3-thiazol-2-yl)-6-oxopyridazine-3-carboxamide has a molecular weight of 250.28 g/mol, XLogP of 0.80, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(4-methyl-1,3-thiazol-2-yl)-6-oxopyridazine-3-carboxamide is sourced from PubChem (CID 2110480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).