N-[[5-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]methyl]cyclopropanesulfonamide

C15H18N8O2S — CID 131642269

IUPACN-[[5-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]methyl]cyclopropanesulfonamide
SMILESO=S(=O)(NCC1CN(c2ccc3nncn3n2)Cc2ccnn21)C1CC1
InChIInChI=1S/C15H18N8O2S/c24-26(25,13-1-2-13)18-7-12-9-21(8-11-5-6-17-23(11)12)15-4-3-14-19-16-10-22(14)20-15/h3-6,10,12-13,18H,1-2,7-9H2
InChIKeyIHINLMPIQDMIJS-UHFFFAOYSA-N
MW374.43 g/mol
LogP-0.04
Rot. Bonds5

About N-[[5-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]methyl]cyclopropanesulfonamide

N-[[5-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]methyl]cyclopropanesulfonamide (PubChem CID 131642269) has the molecular formula C15H18N8O2S and a molecular weight of 374.43 g/mol. Its IUPAC name is N-[[5-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]methyl]cyclopropanesulfonamide.

Molecular Properties

Compound NameN-[[5-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]methyl]cyclopropanesulfonamide
PubChem CID131642269
Molecular FormulaC15H18N8O2S
Molecular Weight374.43 g/mol
Exact Mass374.13
IUPAC NameN-[[5-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]methyl]cyclopropanesulfonamide
SMILESO=S(=O)(NCC1CN(c2ccc3nncn3n2)Cc2ccnn21)C1CC1
InChIInChI=1S/C15H18N8O2S/c24-26(25,13-1-2-13)18-7-12-9-21(8-11-5-6-17-23(11)12)15-4-3-14-19-16-10-22(14)20-15/h3-6,10,12-13,18H,1-2,7-9H2
InChIKeyIHINLMPIQDMIJS-UHFFFAOYSA-N
XLogP-0.04
TPSA110.31 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.43
LogP ≤ 5-0.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Analyze N-[[5-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]methyl]cyclopropanesulfonamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[[5-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]methyl]cyclopropanesulfonamide?
The IUPAC name of N-[[5-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]methyl]cyclopropanesulfonamide (CID 131642269) is N-[[5-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]methyl]cyclopropanesulfonamide.
What is the SMILES notation for N-[[5-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]methyl]cyclopropanesulfonamide?
The canonical SMILES for N-[[5-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]methyl]cyclopropanesulfonamide is O=S(=O)(NCC1CN(c2ccc3nncn3n2)Cc2ccnn21)C1CC1.
What is the InChIKey of N-[[5-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]methyl]cyclopropanesulfonamide?
The InChIKey is IHINLMPIQDMIJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N8O2S/c24-26(25,13-1-2-13)18-7-12-9-21(8-11-5-6-17-23(11)12)15-4-3-14-19-16-10-22(14)20-15/h3-6,10,12-13,18H,1-2,7-9H2.
What are the key properties of N-[[5-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]methyl]cyclopropanesulfonamide?
N-[[5-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]methyl]cyclopropanesulfonamide has a molecular weight of 374.43 g/mol, XLogP of -0.04, 5 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]methyl]cyclopropanesulfonamide is sourced from PubChem (CID 131642269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).