[3-(oxetan-3-yloxy)pyridazin-4-yl]methanamine

C8H11N3O2 — CID 102605386

IUPAC[3-(oxetan-3-yloxy)pyridazin-4-yl]methanamine
SMILESNCc1ccnnc1OC1COC1
InChIInChI=1S/C8H11N3O2/c9-3-6-1-2-10-11-8(6)13-7-4-12-5-7/h1-2,7H,3-5,9H2
InChIKeyQCNPVBCZSSMWPS-UHFFFAOYSA-N
MW181.19 g/mol
LogP-0.29
Rot. Bonds3

About [3-(oxetan-3-yloxy)pyridazin-4-yl]methanamine

[3-(oxetan-3-yloxy)pyridazin-4-yl]methanamine (PubChem CID 102605386) has the molecular formula C8H11N3O2 and a molecular weight of 181.19 g/mol. Its IUPAC name is [3-(oxetan-3-yloxy)pyridazin-4-yl]methanamine.

Molecular Properties

Compound Name[3-(oxetan-3-yloxy)pyridazin-4-yl]methanamine
PubChem CID102605386
Molecular FormulaC8H11N3O2
Molecular Weight181.19 g/mol
Exact Mass181.09
IUPAC Name[3-(oxetan-3-yloxy)pyridazin-4-yl]methanamine
SMILESNCc1ccnnc1OC1COC1
InChIInChI=1S/C8H11N3O2/c9-3-6-1-2-10-11-8(6)13-7-4-12-5-7/h1-2,7H,3-5,9H2
InChIKeyQCNPVBCZSSMWPS-UHFFFAOYSA-N
XLogP-0.29
TPSA70.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.19
LogP ≤ 5-0.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[3-(4-methylcyclohexyl)oxypyridazin-4-yl]methanamine
CID 80507790
[1-(oxetan-3-yloxy)isoquinolin-4-yl]methanamine
CID 106777582
(3-phenoxypyridazin-4-yl)methanamine
CID 80507739
[3-(3-methylbutan-2-yloxy)pyridazin-4-yl]methanamine
CID 80507730
[5-bromo-6-(oxetan-3-yloxy)-3-pyridinyl]methanamine
CID 130550933
[3-(4-ethoxyphenoxy)pyridazin-4-yl]methanamine
CID 80508075
[3-(4-propylphenoxy)pyridazin-4-yl]methanamine
CID 80507890
[3-(1-ethoxypropan-2-yloxy)pyridazin-4-yl]methanamine
CID 103486302
[3-[(1-methylpiperidin-2-yl)methoxy]pyridazin-4-yl]methanamine
CID 80507893
4-[[3-(aminomethyl)-2-pyridinyl]oxy]cyclohexan-1-amine
CID 117096825
[3-(2-chloro-4-fluorophenoxy)pyridazin-4-yl]methanamine
CID 80507987
[3-(2-bromo-4-fluorophenoxy)pyridazin-4-yl]methanamine
CID 80507794

Frequently Asked Questions

What is the IUPAC name of [3-(oxetan-3-yloxy)pyridazin-4-yl]methanamine?
The IUPAC name of [3-(oxetan-3-yloxy)pyridazin-4-yl]methanamine (CID 102605386) is [3-(oxetan-3-yloxy)pyridazin-4-yl]methanamine.
What is the SMILES notation for [3-(oxetan-3-yloxy)pyridazin-4-yl]methanamine?
The canonical SMILES for [3-(oxetan-3-yloxy)pyridazin-4-yl]methanamine is NCc1ccnnc1OC1COC1.
What is the InChIKey of [3-(oxetan-3-yloxy)pyridazin-4-yl]methanamine?
The InChIKey is QCNPVBCZSSMWPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O2/c9-3-6-1-2-10-11-8(6)13-7-4-12-5-7/h1-2,7H,3-5,9H2.
What are the key properties of [3-(oxetan-3-yloxy)pyridazin-4-yl]methanamine?
[3-(oxetan-3-yloxy)pyridazin-4-yl]methanamine has a molecular weight of 181.19 g/mol, XLogP of -0.29, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(oxetan-3-yloxy)pyridazin-4-yl]methanamine is sourced from PubChem (CID 102605386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).