3-chloro-5-propan-2-yloxypyridazine

C7H9ClN2O — CID 71302956

IUPAC3-chloro-5-propan-2-yloxypyridazine
SMILESCC(C)Oc1cnnc(Cl)c1
InChIInChI=1S/C7H9ClN2O/c1-5(2)11-6-3-7(8)10-9-4-6/h3-5H,1-2H3
InChIKeyAZHUYZCBYIYFQJ-UHFFFAOYSA-N
MW172.62 g/mol
LogP1.92
Rot. Bonds2

About 3-chloro-5-propan-2-yloxypyridazine

3-chloro-5-propan-2-yloxypyridazine (PubChem CID 71302956) has the molecular formula C7H9ClN2O and a molecular weight of 172.62 g/mol. Its IUPAC name is 3-chloro-5-propan-2-yloxypyridazine.

Molecular Properties

Compound Name3-chloro-5-propan-2-yloxypyridazine
PubChem CID71302956
Molecular FormulaC7H9ClN2O
Molecular Weight172.62 g/mol
Exact Mass172.04
IUPAC Name3-chloro-5-propan-2-yloxypyridazine
SMILESCC(C)Oc1cnnc(Cl)c1
InChIInChI=1S/C7H9ClN2O/c1-5(2)11-6-3-7(8)10-9-4-6/h3-5H,1-2H3
InChIKeyAZHUYZCBYIYFQJ-UHFFFAOYSA-N
XLogP1.92
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.62
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-5-propan-2-yloxypyridazine?
The IUPAC name of 3-chloro-5-propan-2-yloxypyridazine (CID 71302956) is 3-chloro-5-propan-2-yloxypyridazine.
What is the SMILES notation for 3-chloro-5-propan-2-yloxypyridazine?
The canonical SMILES for 3-chloro-5-propan-2-yloxypyridazine is CC(C)Oc1cnnc(Cl)c1.
What is the InChIKey of 3-chloro-5-propan-2-yloxypyridazine?
The InChIKey is AZHUYZCBYIYFQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9ClN2O/c1-5(2)11-6-3-7(8)10-9-4-6/h3-5H,1-2H3.
What are the key properties of 3-chloro-5-propan-2-yloxypyridazine?
3-chloro-5-propan-2-yloxypyridazine has a molecular weight of 172.62 g/mol, XLogP of 1.92, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-5-propan-2-yloxypyridazine is sourced from PubChem (CID 71302956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).