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

C10H15N3O — CID 106833998

IUPACN-(pyridazin-3-ylmethyl)oxan-4-amine
SMILESc1cnnc(CNC2CCOCC2)c1
InChIInChI=1S/C10H15N3O/c1-2-10(13-12-5-1)8-11-9-3-6-14-7-4-9/h1-2,5,9,11H,3-4,6-8H2
InChIKeyDQBUKKBZNGESAX-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.75
Rot. Bonds3

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

N-(pyridazin-3-ylmethyl)oxan-4-amine (PubChem CID 106833998) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is N-(pyridazin-3-ylmethyl)oxan-4-amine.

Molecular Properties

Compound NameN-(pyridazin-3-ylmethyl)oxan-4-amine
PubChem CID106833998
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC NameN-(pyridazin-3-ylmethyl)oxan-4-amine
SMILESc1cnnc(CNC2CCOCC2)c1
InChIInChI=1S/C10H15N3O/c1-2-10(13-12-5-1)8-11-9-3-6-14-7-4-9/h1-2,5,9,11H,3-4,6-8H2
InChIKeyDQBUKKBZNGESAX-UHFFFAOYSA-N
XLogP0.75
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(pyridazin-3-ylmethyl)oxan-4-amine?
The IUPAC name of N-(pyridazin-3-ylmethyl)oxan-4-amine (CID 106833998) is N-(pyridazin-3-ylmethyl)oxan-4-amine.
What is the SMILES notation for N-(pyridazin-3-ylmethyl)oxan-4-amine?
The canonical SMILES for N-(pyridazin-3-ylmethyl)oxan-4-amine is c1cnnc(CNC2CCOCC2)c1.
What is the InChIKey of N-(pyridazin-3-ylmethyl)oxan-4-amine?
The InChIKey is DQBUKKBZNGESAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-2-10(13-12-5-1)8-11-9-3-6-14-7-4-9/h1-2,5,9,11H,3-4,6-8H2.
What are the key properties of N-(pyridazin-3-ylmethyl)oxan-4-amine?
N-(pyridazin-3-ylmethyl)oxan-4-amine has a molecular weight of 193.25 g/mol, XLogP of 0.75, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(pyridazin-3-ylmethyl)oxan-4-amine is sourced from PubChem (CID 106833998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).