3-piperidin-1-yl-6-propan-2-yloxypyridazine

C12H19N3O — CID 158030889

IUPAC3-piperidin-1-yl-6-propan-2-yloxypyridazine
SMILESCC(C)Oc1ccc(N2CCCCC2)nn1
InChIInChI=1S/C12H19N3O/c1-10(2)16-12-7-6-11(13-14-12)15-8-4-3-5-9-15/h6-7,10H,3-5,8-9H2,1-2H3
InChIKeyFHDXLAZVINJZKE-UHFFFAOYSA-N
MW221.30 g/mol
LogP2.25
Rot. Bonds3

About 3-piperidin-1-yl-6-propan-2-yloxypyridazine

3-piperidin-1-yl-6-propan-2-yloxypyridazine (PubChem CID 158030889) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is 3-piperidin-1-yl-6-propan-2-yloxypyridazine.

Molecular Properties

Compound Name3-piperidin-1-yl-6-propan-2-yloxypyridazine
PubChem CID158030889
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name3-piperidin-1-yl-6-propan-2-yloxypyridazine
SMILESCC(C)Oc1ccc(N2CCCCC2)nn1
InChIInChI=1S/C12H19N3O/c1-10(2)16-12-7-6-11(13-14-12)15-8-4-3-5-9-15/h6-7,10H,3-5,8-9H2,1-2H3
InChIKeyFHDXLAZVINJZKE-UHFFFAOYSA-N
XLogP2.25
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-piperidin-1-yl-6-propan-2-yloxypyridazine?
The IUPAC name of 3-piperidin-1-yl-6-propan-2-yloxypyridazine (CID 158030889) is 3-piperidin-1-yl-6-propan-2-yloxypyridazine.
What is the SMILES notation for 3-piperidin-1-yl-6-propan-2-yloxypyridazine?
The canonical SMILES for 3-piperidin-1-yl-6-propan-2-yloxypyridazine is CC(C)Oc1ccc(N2CCCCC2)nn1.
What is the InChIKey of 3-piperidin-1-yl-6-propan-2-yloxypyridazine?
The InChIKey is FHDXLAZVINJZKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-10(2)16-12-7-6-11(13-14-12)15-8-4-3-5-9-15/h6-7,10H,3-5,8-9H2,1-2H3.
What are the key properties of 3-piperidin-1-yl-6-propan-2-yloxypyridazine?
3-piperidin-1-yl-6-propan-2-yloxypyridazine has a molecular weight of 221.30 g/mol, XLogP of 2.25, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperidin-1-yl-6-propan-2-yloxypyridazine is sourced from PubChem (CID 158030889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).