5-methyl-N-(oxan-4-ylmethyl)pyridazin-3-amine

C11H17N3O — CID 106549759

IUPAC5-methyl-N-(oxan-4-ylmethyl)pyridazin-3-amine
SMILESCc1cnnc(NCC2CCOCC2)c1
InChIInChI=1S/C11H17N3O/c1-9-6-11(14-13-7-9)12-8-10-2-4-15-5-3-10/h6-7,10H,2-5,8H2,1H3,(H,12,14)
InChIKeyWNTDHVKBKNTUHY-UHFFFAOYSA-N
MW207.28 g/mol
LogP1.62
Rot. Bonds3

About 5-methyl-N-(oxan-4-ylmethyl)pyridazin-3-amine

5-methyl-N-(oxan-4-ylmethyl)pyridazin-3-amine (PubChem CID 106549759) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is 5-methyl-N-(oxan-4-ylmethyl)pyridazin-3-amine.

Molecular Properties

Compound Name5-methyl-N-(oxan-4-ylmethyl)pyridazin-3-amine
PubChem CID106549759
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name5-methyl-N-(oxan-4-ylmethyl)pyridazin-3-amine
SMILESCc1cnnc(NCC2CCOCC2)c1
InChIInChI=1S/C11H17N3O/c1-9-6-11(14-13-7-9)12-8-10-2-4-15-5-3-10/h6-7,10H,2-5,8H2,1H3,(H,12,14)
InChIKeyWNTDHVKBKNTUHY-UHFFFAOYSA-N
XLogP1.62
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(oxan-4-ylmethyl)pyridazin-3-amine?
The IUPAC name of 5-methyl-N-(oxan-4-ylmethyl)pyridazin-3-amine (CID 106549759) is 5-methyl-N-(oxan-4-ylmethyl)pyridazin-3-amine.
What is the SMILES notation for 5-methyl-N-(oxan-4-ylmethyl)pyridazin-3-amine?
The canonical SMILES for 5-methyl-N-(oxan-4-ylmethyl)pyridazin-3-amine is Cc1cnnc(NCC2CCOCC2)c1.
What is the InChIKey of 5-methyl-N-(oxan-4-ylmethyl)pyridazin-3-amine?
The InChIKey is WNTDHVKBKNTUHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-9-6-11(14-13-7-9)12-8-10-2-4-15-5-3-10/h6-7,10H,2-5,8H2,1H3,(H,12,14).
What are the key properties of 5-methyl-N-(oxan-4-ylmethyl)pyridazin-3-amine?
5-methyl-N-(oxan-4-ylmethyl)pyridazin-3-amine has a molecular weight of 207.28 g/mol, XLogP of 1.62, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(oxan-4-ylmethyl)pyridazin-3-amine is sourced from PubChem (CID 106549759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).