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

C8H11N3O — CID 62784976

IUPACN-methyl-7,8-dihydro-5H-pyrano[4,3-c]pyridazin-3-amine
SMILESCNc1cc2c(nn1)CCOC2
InChIInChI=1S/C8H11N3O/c1-9-8-4-6-5-12-3-2-7(6)10-11-8/h4H,2-3,5H2,1H3,(H,9,11)
InChIKeyKNWGKERXUXELCY-UHFFFAOYSA-N
MW165.20 g/mol
LogP0.59
Rot. Bonds1

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

N-methyl-7,8-dihydro-5H-pyrano[4,3-c]pyridazin-3-amine (PubChem CID 62784976) has the molecular formula C8H11N3O and a molecular weight of 165.20 g/mol. Its IUPAC name is N-methyl-7,8-dihydro-5H-pyrano[4,3-c]pyridazin-3-amine.

Molecular Properties

Compound NameN-methyl-7,8-dihydro-5H-pyrano[4,3-c]pyridazin-3-amine
PubChem CID62784976
Molecular FormulaC8H11N3O
Molecular Weight165.20 g/mol
Exact Mass165.09
IUPAC NameN-methyl-7,8-dihydro-5H-pyrano[4,3-c]pyridazin-3-amine
SMILESCNc1cc2c(nn1)CCOC2
InChIInChI=1S/C8H11N3O/c1-9-8-4-6-5-12-3-2-7(6)10-11-8/h4H,2-3,5H2,1H3,(H,9,11)
InChIKeyKNWGKERXUXELCY-UHFFFAOYSA-N
XLogP0.59
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.20
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-7,8-dihydro-5H-pyrano[4,3-c]pyridazin-3-amine?
The IUPAC name of N-methyl-7,8-dihydro-5H-pyrano[4,3-c]pyridazin-3-amine (CID 62784976) is N-methyl-7,8-dihydro-5H-pyrano[4,3-c]pyridazin-3-amine.
What is the SMILES notation for N-methyl-7,8-dihydro-5H-pyrano[4,3-c]pyridazin-3-amine?
The canonical SMILES for N-methyl-7,8-dihydro-5H-pyrano[4,3-c]pyridazin-3-amine is CNc1cc2c(nn1)CCOC2.
What is the InChIKey of N-methyl-7,8-dihydro-5H-pyrano[4,3-c]pyridazin-3-amine?
The InChIKey is KNWGKERXUXELCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O/c1-9-8-4-6-5-12-3-2-7(6)10-11-8/h4H,2-3,5H2,1H3,(H,9,11).
What are the key properties of N-methyl-7,8-dihydro-5H-pyrano[4,3-c]pyridazin-3-amine?
N-methyl-7,8-dihydro-5H-pyrano[4,3-c]pyridazin-3-amine has a molecular weight of 165.20 g/mol, XLogP of 0.59, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-7,8-dihydro-5H-pyrano[4,3-c]pyridazin-3-amine is sourced from PubChem (CID 62784976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).