7-ethenyl-8-[(Z)-prop-1-enyl]-5H-[1,2,4]triazolo[4,3-b]pyridazin-6-one

C10H10N4O — CID 145324809

IUPAC7-ethenyl-8-[(Z)-prop-1-enyl]-5H-[1,2,4]triazolo[4,3-b]pyridazin-6-one
SMILESC=Cc1c(/C=C\C)c2nncn2[nH]c1=O
InChIInChI=1S/C10H10N4O/c1-3-5-8-7(4-2)10(15)13-14-6-11-12-9(8)14/h3-6H,2H2,1H3,(H,13,15)/b5-3-
InChIKeyDJHNIAQCAWWDKD-HYXAFXHYSA-N
MW202.22 g/mol
LogP1.09
Rot. Bonds2

About 7-ethenyl-8-[(Z)-prop-1-enyl]-5H-[1,2,4]triazolo[4,3-b]pyridazin-6-one

7-ethenyl-8-[(Z)-prop-1-enyl]-5H-[1,2,4]triazolo[4,3-b]pyridazin-6-one (PubChem CID 145324809) has the molecular formula C10H10N4O and a molecular weight of 202.22 g/mol. Its IUPAC name is 7-ethenyl-8-[(Z)-prop-1-enyl]-5H-[1,2,4]triazolo[4,3-b]pyridazin-6-one.

Molecular Properties

Compound Name7-ethenyl-8-[(Z)-prop-1-enyl]-5H-[1,2,4]triazolo[4,3-b]pyridazin-6-one
PubChem CID145324809
Molecular FormulaC10H10N4O
Molecular Weight202.22 g/mol
Exact Mass202.09
IUPAC Name7-ethenyl-8-[(Z)-prop-1-enyl]-5H-[1,2,4]triazolo[4,3-b]pyridazin-6-one
SMILESC=Cc1c(/C=C\C)c2nncn2[nH]c1=O
InChIInChI=1S/C10H10N4O/c1-3-5-8-7(4-2)10(15)13-14-6-11-12-9(8)14/h3-6H,2H2,1H3,(H,13,15)/b5-3-
InChIKeyDJHNIAQCAWWDKD-HYXAFXHYSA-N
XLogP1.09
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.22
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 7-ethenyl-8-[(Z)-prop-1-enyl]-5H-[1,2,4]triazolo[4,3-b]pyridazin-6-one with MolForge

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Related Compounds

7-Ethyl-8-methyl[1,2,4]triazolo[4,3-b]pyridazin-6-ol
CID 658404
[1,2,4]Triazolo[1,5-b]pyridazin-6-ol, 8-methyl-
CID 1511412
7-tert-butyl-5H-[1,2,4]triazolo[4,3-b]pyridazin-6-one
CID 132111467
3-ethyl-6-methyl-5-(1H-1,2,4-triazol-5-yl)-1H-pyridin-2-one
CID 135425120
(Z)-3-[3-[(3E,5Z)-octa-1,3,5,7-tetraen-4-yl]-1,2,4-triazol-1-yl]prop-2-enehydrazide
CID 137482081
1-methyl-5-(1H-1,2,4-triazol-5-yl)pyridin-2-one
CID 141127086
ethane;(Z)-3-[3-[(3E,5Z)-octa-1,3,5,7-tetraen-4-yl]-1,2,4-triazol-1-yl]prop-2-enehydrazide
CID 144709480
ethane;11-[(2E,4Z)-2-ethenylhepta-2,4,6-trienyl]-3,4,6,7,11-pentazatricyclo[7.4.0.02,6]trideca-1(9),2,4-trien-8-one
CID 171552366
8-Methyl[1,2,4]triazolo[4,3-b]pyridazin-6-ol
CID 3826397
11-[(2E,4Z)-2-ethenylhepta-2,4,6-trienyl]-3,4,6,7,11-pentazatricyclo[7.4.0.02,6]trideca-1(9),2,4-trien-8-one
CID 171552367

Frequently Asked Questions

What is the IUPAC name of 7-ethenyl-8-[(Z)-prop-1-enyl]-5H-[1,2,4]triazolo[4,3-b]pyridazin-6-one?
The IUPAC name of 7-ethenyl-8-[(Z)-prop-1-enyl]-5H-[1,2,4]triazolo[4,3-b]pyridazin-6-one (CID 145324809) is 7-ethenyl-8-[(Z)-prop-1-enyl]-5H-[1,2,4]triazolo[4,3-b]pyridazin-6-one.
What is the SMILES notation for 7-ethenyl-8-[(Z)-prop-1-enyl]-5H-[1,2,4]triazolo[4,3-b]pyridazin-6-one?
The canonical SMILES for 7-ethenyl-8-[(Z)-prop-1-enyl]-5H-[1,2,4]triazolo[4,3-b]pyridazin-6-one is C=Cc1c(/C=C\C)c2nncn2[nH]c1=O.
What is the InChIKey of 7-ethenyl-8-[(Z)-prop-1-enyl]-5H-[1,2,4]triazolo[4,3-b]pyridazin-6-one?
The InChIKey is DJHNIAQCAWWDKD-HYXAFXHYSA-N. The full InChI is InChI=1S/C10H10N4O/c1-3-5-8-7(4-2)10(15)13-14-6-11-12-9(8)14/h3-6H,2H2,1H3,(H,13,15)/b5-3-.
What are the key properties of 7-ethenyl-8-[(Z)-prop-1-enyl]-5H-[1,2,4]triazolo[4,3-b]pyridazin-6-one?
7-ethenyl-8-[(Z)-prop-1-enyl]-5H-[1,2,4]triazolo[4,3-b]pyridazin-6-one has a molecular weight of 202.22 g/mol, XLogP of 1.09, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethenyl-8-[(Z)-prop-1-enyl]-5H-[1,2,4]triazolo[4,3-b]pyridazin-6-one is sourced from PubChem (CID 145324809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).