5-methoxy-3-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyridazine

C10H9F3N4O2 — CID 19436789

IUPAC5-methoxy-3-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyridazine
SMILESCOc1cnnc(Oc2cc(C(F)(F)F)nn2C)c1
InChIInChI=1S/C10H9F3N4O2/c1-17-9(4-7(16-17)10(11,12)13)19-8-3-6(18-2)5-14-15-8/h3-5H,1-2H3
InChIKeyGWTPKJYMXCEUJP-UHFFFAOYSA-N
MW274.20 g/mol
LogP2.03
Rot. Bonds3

About 5-methoxy-3-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyridazine

5-methoxy-3-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyridazine (PubChem CID 19436789) has the molecular formula C10H9F3N4O2 and a molecular weight of 274.20 g/mol. Its IUPAC name is 5-methoxy-3-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyridazine.

Molecular Properties

Compound Name5-methoxy-3-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyridazine
PubChem CID19436789
Molecular FormulaC10H9F3N4O2
Molecular Weight274.20 g/mol
Exact Mass274.07
IUPAC Name5-methoxy-3-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyridazine
SMILESCOc1cnnc(Oc2cc(C(F)(F)F)nn2C)c1
InChIInChI=1S/C10H9F3N4O2/c1-17-9(4-7(16-17)10(11,12)13)19-8-3-6(18-2)5-14-15-8/h3-5H,1-2H3
InChIKeyGWTPKJYMXCEUJP-UHFFFAOYSA-N
XLogP2.03
TPSA62.06 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.20
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

3-[2-Ethyl-5-(trifluoromethyl)pyrazol-3-yl]oxy-5-methoxypyridazine
CID 19436777
5-ethoxy-3-[[1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]oxy]pyridazine
CID 19436778
3-chloro-4-methoxy-6-[[1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]oxy]pyridazine
CID 19436779
3-[[3-(Difluoromethyl)-1-methyl-1H-pyrazol-5-yl]oxy]-5-methoxypyridazine
CID 19436780
5-methoxy-3-[[3-(trifluoromethyl)-1H-pyrazol-5-yl]oxy]pyridazine
CID 19436785
5-Bromo-3-[[1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]oxy]pyridazine
CID 19436792
5-methoxy-3-[[1-(tetrahydro-2H-pyran-2-yl)-3-(trifluoromethyl)-1H-pyrazol-5-yl]oxy]pyridazine
CID 19436793
5-(difluoromethoxy)-3-[[1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]oxy]pyridazine
CID 19436795
5-[(5-methoxy-3-pyridazinyl)oxy]-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxaldehyde
CID 19436797
5-methoxy-3-[[1-methyl-4-nitro-3-(trifluoromethyl)-1H-pyrazol-5-yl]oxy]pyridazine
CID 19436799
5-ethenyl-3-[[1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]oxy]pyridazine
CID 19436801
6-[2-Methyl-5-(trifluoromethyl)pyrazol-3-yl]oxypyridazine-4-carbonitrile
CID 19436803

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-3-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyridazine?
The IUPAC name of 5-methoxy-3-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyridazine (CID 19436789) is 5-methoxy-3-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyridazine.
What is the SMILES notation for 5-methoxy-3-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyridazine?
The canonical SMILES for 5-methoxy-3-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyridazine is COc1cnnc(Oc2cc(C(F)(F)F)nn2C)c1.
What is the InChIKey of 5-methoxy-3-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyridazine?
The InChIKey is GWTPKJYMXCEUJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F3N4O2/c1-17-9(4-7(16-17)10(11,12)13)19-8-3-6(18-2)5-14-15-8/h3-5H,1-2H3.
What are the key properties of 5-methoxy-3-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyridazine?
5-methoxy-3-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyridazine has a molecular weight of 274.20 g/mol, XLogP of 2.03, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-3-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxypyridazine is sourced from PubChem (CID 19436789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).