2-(azetidin-3-yl)-6-cyclopropylpyridazin-3-one

C10H13N3O — CID 126857348

IUPAC2-(azetidin-3-yl)-6-cyclopropylpyridazin-3-one
SMILESO=c1ccc(C2CC2)nn1C1CNC1
InChIInChI=1S/C10H13N3O/c14-10-4-3-9(7-1-2-7)12-13(10)8-5-11-6-8/h3-4,7-8,11H,1-2,5-6H2
InChIKeyCTTRCPVGDZCUSY-UHFFFAOYSA-N
MW191.23 g/mol
LogP0.26
Rot. Bonds2

About 2-(azetidin-3-yl)-6-cyclopropylpyridazin-3-one

2-(azetidin-3-yl)-6-cyclopropylpyridazin-3-one (PubChem CID 126857348) has the molecular formula C10H13N3O and a molecular weight of 191.23 g/mol. Its IUPAC name is 2-(azetidin-3-yl)-6-cyclopropylpyridazin-3-one.

Molecular Properties

Compound Name2-(azetidin-3-yl)-6-cyclopropylpyridazin-3-one
PubChem CID126857348
Molecular FormulaC10H13N3O
Molecular Weight191.23 g/mol
Exact Mass191.11
IUPAC Name2-(azetidin-3-yl)-6-cyclopropylpyridazin-3-one
SMILESO=c1ccc(C2CC2)nn1C1CNC1
InChIInChI=1S/C10H13N3O/c14-10-4-3-9(7-1-2-7)12-13(10)8-5-11-6-8/h3-4,7-8,11H,1-2,5-6H2
InChIKeyCTTRCPVGDZCUSY-UHFFFAOYSA-N
XLogP0.26
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 50.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-3-yl)-6-cyclopropylpyridazin-3-one?
The IUPAC name of 2-(azetidin-3-yl)-6-cyclopropylpyridazin-3-one (CID 126857348) is 2-(azetidin-3-yl)-6-cyclopropylpyridazin-3-one.
What is the SMILES notation for 2-(azetidin-3-yl)-6-cyclopropylpyridazin-3-one?
The canonical SMILES for 2-(azetidin-3-yl)-6-cyclopropylpyridazin-3-one is O=c1ccc(C2CC2)nn1C1CNC1.
What is the InChIKey of 2-(azetidin-3-yl)-6-cyclopropylpyridazin-3-one?
The InChIKey is CTTRCPVGDZCUSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O/c14-10-4-3-9(7-1-2-7)12-13(10)8-5-11-6-8/h3-4,7-8,11H,1-2,5-6H2.
What are the key properties of 2-(azetidin-3-yl)-6-cyclopropylpyridazin-3-one?
2-(azetidin-3-yl)-6-cyclopropylpyridazin-3-one has a molecular weight of 191.23 g/mol, XLogP of 0.26, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-3-yl)-6-cyclopropylpyridazin-3-one is sourced from PubChem (CID 126857348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).