1-methyl-6-oxo-N-pyrazolo[1,5-a]pyrimidin-6-ylpyridazine-3-carboxamide

C12H10N6O2 — CID 91629096

IUPAC1-methyl-6-oxo-N-pyrazolo[1,5-a]pyrimidin-6-ylpyridazine-3-carboxamide
SMILESCn1nc(C(=O)Nc2cnc3ccnn3c2)ccc1=O
InChIInChI=1S/C12H10N6O2/c1-17-11(19)3-2-9(16-17)12(20)15-8-6-13-10-4-5-14-18(10)7-8/h2-7H,1H3,(H,15,20)
InChIKeyINFIGUIWRLSCSF-UHFFFAOYSA-N
MW270.25 g/mol
LogP0.08
Rot. Bonds2

About 1-methyl-6-oxo-N-pyrazolo[1,5-a]pyrimidin-6-ylpyridazine-3-carboxamide

1-methyl-6-oxo-N-pyrazolo[1,5-a]pyrimidin-6-ylpyridazine-3-carboxamide (PubChem CID 91629096) has the molecular formula C12H10N6O2 and a molecular weight of 270.25 g/mol. Its IUPAC name is 1-methyl-6-oxo-N-pyrazolo[1,5-a]pyrimidin-6-ylpyridazine-3-carboxamide.

Molecular Properties

Compound Name1-methyl-6-oxo-N-pyrazolo[1,5-a]pyrimidin-6-ylpyridazine-3-carboxamide
PubChem CID91629096
Molecular FormulaC12H10N6O2
Molecular Weight270.25 g/mol
Exact Mass270.09
IUPAC Name1-methyl-6-oxo-N-pyrazolo[1,5-a]pyrimidin-6-ylpyridazine-3-carboxamide
SMILESCn1nc(C(=O)Nc2cnc3ccnn3c2)ccc1=O
InChIInChI=1S/C12H10N6O2/c1-17-11(19)3-2-9(16-17)12(20)15-8-6-13-10-4-5-14-18(10)7-8/h2-7H,1H3,(H,15,20)
InChIKeyINFIGUIWRLSCSF-UHFFFAOYSA-N
XLogP0.08
TPSA94.18 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.25
LogP ≤ 50.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

7-Amino-5-[[6-methyl-2-(1-methylpyrazol-4-yl)-3-oxopyridazin-4-yl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 137449123
7-Amino-5-[[5-methyl-1-(1-methylpyrazol-4-yl)-2-oxo-3-pyridinyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 137449655
2-methyl-5-[2-([1,2,4]triazolo[1,5-a]pyrimidin-2-yl)ethyl]-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 137348711
N-pyrazolo[1,5-a]pyrimidin-3-ylacetamide
CID 172825317
N-pyrazolo[1,5-a]pyrimidin-3-ylpyrrolidine-1-carboxamide
CID 176141987
7-(Methylamino)-5-[[6-methyl-2-(1-methylpyrazol-4-yl)-3-oxopyridazin-4-yl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 137449127
1-methyl-2-oxo-N-[2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-6-yl]-1,2-dihydropyridine-3-carboxamide
CID 91629060
N-(pyrazolo[1,5-a]pyrimidin-6-yl)pivalamide
CID 91629099
Ethyl pyrazolo[1,5-a]pyrimidin-6-ylcarbamate
CID 91629121
1-methyl-N-{pyrazolo[1,5-a]pyrimidin-6-yl}-1H-1,2,3-triazole-4-carboxamide
CID 91629129
N-(pyrazolo[1,5-a]pyrimidin-6-yl)cyclohex-3-enecarboxamide
CID 91629132
4-ethyl-2,3-dioxo-N-{pyrazolo[1,5-a]pyrimidin-6-yl}piperazine-1-carboxamide
CID 91629162

Frequently Asked Questions

What is the IUPAC name of 1-methyl-6-oxo-N-pyrazolo[1,5-a]pyrimidin-6-ylpyridazine-3-carboxamide?
The IUPAC name of 1-methyl-6-oxo-N-pyrazolo[1,5-a]pyrimidin-6-ylpyridazine-3-carboxamide (CID 91629096) is 1-methyl-6-oxo-N-pyrazolo[1,5-a]pyrimidin-6-ylpyridazine-3-carboxamide.
What is the SMILES notation for 1-methyl-6-oxo-N-pyrazolo[1,5-a]pyrimidin-6-ylpyridazine-3-carboxamide?
The canonical SMILES for 1-methyl-6-oxo-N-pyrazolo[1,5-a]pyrimidin-6-ylpyridazine-3-carboxamide is Cn1nc(C(=O)Nc2cnc3ccnn3c2)ccc1=O.
What is the InChIKey of 1-methyl-6-oxo-N-pyrazolo[1,5-a]pyrimidin-6-ylpyridazine-3-carboxamide?
The InChIKey is INFIGUIWRLSCSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N6O2/c1-17-11(19)3-2-9(16-17)12(20)15-8-6-13-10-4-5-14-18(10)7-8/h2-7H,1H3,(H,15,20).
What are the key properties of 1-methyl-6-oxo-N-pyrazolo[1,5-a]pyrimidin-6-ylpyridazine-3-carboxamide?
1-methyl-6-oxo-N-pyrazolo[1,5-a]pyrimidin-6-ylpyridazine-3-carboxamide has a molecular weight of 270.25 g/mol, XLogP of 0.08, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-6-oxo-N-pyrazolo[1,5-a]pyrimidin-6-ylpyridazine-3-carboxamide is sourced from PubChem (CID 91629096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).