2-(2-cyclopropyl-7-methyl-4-oxofuro[2,3-d]pyridazin-5-yl)-N-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)acetamide

C17H15N7O3 — CID 172632649

IUPAC2-(2-cyclopropyl-7-methyl-4-oxofuro[2,3-d]pyridazin-5-yl)-N-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)acetamide
SMILESCc1nn(CC(=O)Nc2ccc3nncn3n2)c(=O)c2cc(C3CC3)oc12
InChIInChI=1S/C17H15N7O3/c1-9-16-11(6-12(27-16)10-2-3-10)17(26)23(21-9)7-15(25)19-13-4-5-14-20-18-8-24(14)22-13/h4-6,8,10H,2-3,7H2,1H3,(H,19,22,25)
InChIKeyJKTSXRPZAAVTJL-UHFFFAOYSA-N
MW365.35 g/mol
LogP1.25
Rot. Bonds4

About 2-(2-cyclopropyl-7-methyl-4-oxofuro[2,3-d]pyridazin-5-yl)-N-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)acetamide

2-(2-cyclopropyl-7-methyl-4-oxofuro[2,3-d]pyridazin-5-yl)-N-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)acetamide (PubChem CID 172632649) has the molecular formula C17H15N7O3 and a molecular weight of 365.35 g/mol. Its IUPAC name is 2-(2-cyclopropyl-7-methyl-4-oxofuro[2,3-d]pyridazin-5-yl)-N-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)acetamide.

Molecular Properties

Compound Name2-(2-cyclopropyl-7-methyl-4-oxofuro[2,3-d]pyridazin-5-yl)-N-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)acetamide
PubChem CID172632649
Molecular FormulaC17H15N7O3
Molecular Weight365.35 g/mol
Exact Mass365.12
IUPAC Name2-(2-cyclopropyl-7-methyl-4-oxofuro[2,3-d]pyridazin-5-yl)-N-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)acetamide
SMILESCc1nn(CC(=O)Nc2ccc3nncn3n2)c(=O)c2cc(C3CC3)oc12
InChIInChI=1S/C17H15N7O3/c1-9-16-11(6-12(27-16)10-2-3-10)17(26)23(21-9)7-15(25)19-13-4-5-14-20-18-8-24(14)22-13/h4-6,8,10H,2-3,7H2,1H3,(H,19,22,25)
InChIKeyJKTSXRPZAAVTJL-UHFFFAOYSA-N
XLogP1.25
TPSA120.21 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.35
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Analyze 2-(2-cyclopropyl-7-methyl-4-oxofuro[2,3-d]pyridazin-5-yl)-N-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)acetamide with MolForge

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Related Compounds

2-(2-cyclopropyl-7-methyl-4-oxofuro[2,3-d]pyridazin-5-yl)-N-(5-methylpyrimidin-2-yl)acetamide
CID 168980097
N-(5-chloropyrimidin-2-yl)-2-(2-cyclopropyl-7-methyl-4-oxofuro[2,3-d]pyridazin-5-yl)acetamide
CID 168980094
2-[6-(2-fluoropropan-2-yl)-1-oxo-4-propan-2-ylphthalazin-2-yl]-N-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)acetamide
CID 162364165
2-(4-chloro-9-oxo-12-propan-2-yl-5-oxa-1,10,11-triazatricyclo[6.4.0.02,6]dodeca-2(6),3,7,11-tetraen-10-yl)-N-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)acetamide
CID 170983129
ethyl 2-[[2-(2-cyclopropyl-4-oxo-7-propan-2-ylfuro[2,3-d]pyridazin-5-yl)acetyl]amino]pyrimidine-5-carboxylate
CID 168980050
2-(2-ethyl-7-methyl-4-oxofuro[2,3-d]pyridazin-5-yl)-N-pyrimidin-2-ylacetamide
CID 168979973
2-[6-oxo-3-propan-2-yl-4-(3,3,3-trifluoropropoxy)pyridazin-1-yl]-N-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)acetamide
CID 164914340
2-(2-cyclopropyl-8-methyl-5-oxopyrido[2,3-d]pyridazin-6-yl)-N-pyrimidin-2-ylacetamide
CID 168980033
2-(2-cyclopropyl-4-oxo-7-propan-2-ylpyrazolo[1,5-d][1,2,4]triazin-5-yl)-N-(tetrazolo[1,5-b]pyridazin-6-yl)acetamide
CID 166803160
6-cyclopropyl-[1,2,4]triazolo[4,3-b]pyridazine
CID 158504420
2-[1-ethyl-4-oxo-7-(trifluoromethyl)cinnolin-3-yl]-N-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)acetamide
CID 163219141
2-(4-cyclopropyl-3-methylpyrazolo[3,4-b]pyridin-1-yl)-N-(4-methyl-2-pyridinyl)acetamide
CID 19487211

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclopropyl-7-methyl-4-oxofuro[2,3-d]pyridazin-5-yl)-N-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)acetamide?
The IUPAC name of 2-(2-cyclopropyl-7-methyl-4-oxofuro[2,3-d]pyridazin-5-yl)-N-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)acetamide (CID 172632649) is 2-(2-cyclopropyl-7-methyl-4-oxofuro[2,3-d]pyridazin-5-yl)-N-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)acetamide.
What is the SMILES notation for 2-(2-cyclopropyl-7-methyl-4-oxofuro[2,3-d]pyridazin-5-yl)-N-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)acetamide?
The canonical SMILES for 2-(2-cyclopropyl-7-methyl-4-oxofuro[2,3-d]pyridazin-5-yl)-N-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)acetamide is Cc1nn(CC(=O)Nc2ccc3nncn3n2)c(=O)c2cc(C3CC3)oc12.
What is the InChIKey of 2-(2-cyclopropyl-7-methyl-4-oxofuro[2,3-d]pyridazin-5-yl)-N-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)acetamide?
The InChIKey is JKTSXRPZAAVTJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N7O3/c1-9-16-11(6-12(27-16)10-2-3-10)17(26)23(21-9)7-15(25)19-13-4-5-14-20-18-8-24(14)22-13/h4-6,8,10H,2-3,7H2,1H3,(H,19,22,25).
What are the key properties of 2-(2-cyclopropyl-7-methyl-4-oxofuro[2,3-d]pyridazin-5-yl)-N-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)acetamide?
2-(2-cyclopropyl-7-methyl-4-oxofuro[2,3-d]pyridazin-5-yl)-N-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)acetamide has a molecular weight of 365.35 g/mol, XLogP of 1.25, 4 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclopropyl-7-methyl-4-oxofuro[2,3-d]pyridazin-5-yl)-N-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)acetamide is sourced from PubChem (CID 172632649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).