3-(1-ethylazetidin-3-yl)oxy-6-methylpyridazine

C10H15N3O — CID 134505968

IUPAC3-(1-ethylazetidin-3-yl)oxy-6-methylpyridazine
SMILESCCN1CC(Oc2ccc(C)nn2)C1
InChIInChI=1S/C10H15N3O/c1-3-13-6-9(7-13)14-10-5-4-8(2)11-12-10/h4-5,9H,3,6-7H2,1-2H3
InChIKeyYFCKTMTVOLNQIE-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.87
Rot. Bonds3

About 3-(1-ethylazetidin-3-yl)oxy-6-methylpyridazine

3-(1-ethylazetidin-3-yl)oxy-6-methylpyridazine (PubChem CID 134505968) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 3-(1-ethylazetidin-3-yl)oxy-6-methylpyridazine.

Molecular Properties

Compound Name3-(1-ethylazetidin-3-yl)oxy-6-methylpyridazine
PubChem CID134505968
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name3-(1-ethylazetidin-3-yl)oxy-6-methylpyridazine
SMILESCCN1CC(Oc2ccc(C)nn2)C1
InChIInChI=1S/C10H15N3O/c1-3-13-6-9(7-13)14-10-5-4-8(2)11-12-10/h4-5,9H,3,6-7H2,1-2H3
InChIKeyYFCKTMTVOLNQIE-UHFFFAOYSA-N
XLogP0.87
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(1-ethylazetidin-3-yl)oxy-6-methylpyridazine?
The IUPAC name of 3-(1-ethylazetidin-3-yl)oxy-6-methylpyridazine (CID 134505968) is 3-(1-ethylazetidin-3-yl)oxy-6-methylpyridazine.
What is the SMILES notation for 3-(1-ethylazetidin-3-yl)oxy-6-methylpyridazine?
The canonical SMILES for 3-(1-ethylazetidin-3-yl)oxy-6-methylpyridazine is CCN1CC(Oc2ccc(C)nn2)C1.
What is the InChIKey of 3-(1-ethylazetidin-3-yl)oxy-6-methylpyridazine?
The InChIKey is YFCKTMTVOLNQIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-3-13-6-9(7-13)14-10-5-4-8(2)11-12-10/h4-5,9H,3,6-7H2,1-2H3.
What are the key properties of 3-(1-ethylazetidin-3-yl)oxy-6-methylpyridazine?
3-(1-ethylazetidin-3-yl)oxy-6-methylpyridazine has a molecular weight of 193.25 g/mol, XLogP of 0.87, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-ethylazetidin-3-yl)oxy-6-methylpyridazine is sourced from PubChem (CID 134505968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).