3-chloro-5-cyclopropyloxypyridazine

C7H7ClN2O — CID 71302952

IUPAC3-chloro-5-cyclopropyloxypyridazine
SMILESClc1cc(OC2CC2)cnn1
InChIInChI=1S/C7H7ClN2O/c8-7-3-6(4-9-10-7)11-5-1-2-5/h3-5H,1-2H2
InChIKeyMICAJNQOTQGIQI-UHFFFAOYSA-N
MW170.60 g/mol
LogP1.67
Rot. Bonds2

About 3-chloro-5-cyclopropyloxypyridazine

3-chloro-5-cyclopropyloxypyridazine (PubChem CID 71302952) has the molecular formula C7H7ClN2O and a molecular weight of 170.60 g/mol. Its IUPAC name is 3-chloro-5-cyclopropyloxypyridazine.

Molecular Properties

Compound Name3-chloro-5-cyclopropyloxypyridazine
PubChem CID71302952
Molecular FormulaC7H7ClN2O
Molecular Weight170.60 g/mol
Exact Mass170.02
IUPAC Name3-chloro-5-cyclopropyloxypyridazine
SMILESClc1cc(OC2CC2)cnn1
InChIInChI=1S/C7H7ClN2O/c8-7-3-6(4-9-10-7)11-5-1-2-5/h3-5H,1-2H2
InChIKeyMICAJNQOTQGIQI-UHFFFAOYSA-N
XLogP1.67
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.60
LogP ≤ 51.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-5-cyclopropyloxypyridazine?
The IUPAC name of 3-chloro-5-cyclopropyloxypyridazine (CID 71302952) is 3-chloro-5-cyclopropyloxypyridazine.
What is the SMILES notation for 3-chloro-5-cyclopropyloxypyridazine?
The canonical SMILES for 3-chloro-5-cyclopropyloxypyridazine is Clc1cc(OC2CC2)cnn1.
What is the InChIKey of 3-chloro-5-cyclopropyloxypyridazine?
The InChIKey is MICAJNQOTQGIQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7ClN2O/c8-7-3-6(4-9-10-7)11-5-1-2-5/h3-5H,1-2H2.
What are the key properties of 3-chloro-5-cyclopropyloxypyridazine?
3-chloro-5-cyclopropyloxypyridazine has a molecular weight of 170.60 g/mol, XLogP of 1.67, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-5-cyclopropyloxypyridazine is sourced from PubChem (CID 71302952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).