7,8-dihydro-5H-pyrano[4,3-c]pyridazin-3-amine

C7H9N3O — CID 62784228

IUPAC7,8-dihydro-5H-pyrano[4,3-c]pyridazin-3-amine
SMILESNc1cc2c(nn1)CCOC2
InChIInChI=1S/C7H9N3O/c8-7-3-5-4-11-2-1-6(5)9-10-7/h3H,1-2,4H2,(H2,8,10)
InChIKeyIAOIPFIUDFGSJP-UHFFFAOYSA-N
MW151.17 g/mol
LogP0.13
Rot. Bonds

About 7,8-dihydro-5H-pyrano[4,3-c]pyridazin-3-amine

7,8-dihydro-5H-pyrano[4,3-c]pyridazin-3-amine (PubChem CID 62784228) has the molecular formula C7H9N3O and a molecular weight of 151.17 g/mol. Its IUPAC name is 7,8-dihydro-5H-pyrano[4,3-c]pyridazin-3-amine.

Molecular Properties

Compound Name7,8-dihydro-5H-pyrano[4,3-c]pyridazin-3-amine
PubChem CID62784228
Molecular FormulaC7H9N3O
Molecular Weight151.17 g/mol
Exact Mass151.07
IUPAC Name7,8-dihydro-5H-pyrano[4,3-c]pyridazin-3-amine
SMILESNc1cc2c(nn1)CCOC2
InChIInChI=1S/C7H9N3O/c8-7-3-5-4-11-2-1-6(5)9-10-7/h3H,1-2,4H2,(H2,8,10)
InChIKeyIAOIPFIUDFGSJP-UHFFFAOYSA-N
XLogP0.13
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.17
LogP ≤ 50.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7,8-dihydro-5H-pyrano[4,3-c]pyridazin-3-amine?
The IUPAC name of 7,8-dihydro-5H-pyrano[4,3-c]pyridazin-3-amine (CID 62784228) is 7,8-dihydro-5H-pyrano[4,3-c]pyridazin-3-amine.
What is the SMILES notation for 7,8-dihydro-5H-pyrano[4,3-c]pyridazin-3-amine?
The canonical SMILES for 7,8-dihydro-5H-pyrano[4,3-c]pyridazin-3-amine is Nc1cc2c(nn1)CCOC2.
What is the InChIKey of 7,8-dihydro-5H-pyrano[4,3-c]pyridazin-3-amine?
The InChIKey is IAOIPFIUDFGSJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O/c8-7-3-5-4-11-2-1-6(5)9-10-7/h3H,1-2,4H2,(H2,8,10).
What are the key properties of 7,8-dihydro-5H-pyrano[4,3-c]pyridazin-3-amine?
7,8-dihydro-5H-pyrano[4,3-c]pyridazin-3-amine has a molecular weight of 151.17 g/mol, XLogP of 0.13, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7,8-dihydro-5H-pyrano[4,3-c]pyridazin-3-amine is sourced from PubChem (CID 62784228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).