3,6-dichloro-4-(1-propan-2-ylpyrazol-4-yl)oxypyridazine

C10H10Cl2N4O — CID 116801133

IUPAC3,6-dichloro-4-(1-propan-2-ylpyrazol-4-yl)oxypyridazine
SMILESCC(C)n1cc(Oc2cc(Cl)nnc2Cl)cn1
InChIInChI=1S/C10H10Cl2N4O/c1-6(2)16-5-7(4-13-16)17-8-3-9(11)14-15-10(8)12/h3-6H,1-2H3
InChIKeyMDDQXEFCLTZQOY-UHFFFAOYSA-N
MW273.12 g/mol
LogP3.35
Rot. Bonds3

About 3,6-dichloro-4-(1-propan-2-ylpyrazol-4-yl)oxypyridazine

3,6-dichloro-4-(1-propan-2-ylpyrazol-4-yl)oxypyridazine (PubChem CID 116801133) has the molecular formula C10H10Cl2N4O and a molecular weight of 273.12 g/mol. Its IUPAC name is 3,6-dichloro-4-(1-propan-2-ylpyrazol-4-yl)oxypyridazine.

Molecular Properties

Compound Name3,6-dichloro-4-(1-propan-2-ylpyrazol-4-yl)oxypyridazine
PubChem CID116801133
Molecular FormulaC10H10Cl2N4O
Molecular Weight273.12 g/mol
Exact Mass272.02
IUPAC Name3,6-dichloro-4-(1-propan-2-ylpyrazol-4-yl)oxypyridazine
SMILESCC(C)n1cc(Oc2cc(Cl)nnc2Cl)cn1
InChIInChI=1S/C10H10Cl2N4O/c1-6(2)16-5-7(4-13-16)17-8-3-9(11)14-15-10(8)12/h3-6H,1-2H3
InChIKeyMDDQXEFCLTZQOY-UHFFFAOYSA-N
XLogP3.35
TPSA52.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.12
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4,5-dimethoxy-2-(1-propan-2-ylpyrazol-4-yl)oxyaniline
CID 116800610
5-chloro-N'-hydroxy-2-(1-propan-2-ylpyrazol-4-yl)oxybenzenecarboximidamide
CID 116801481
2,4-dichloro-6-(1-propan-2-ylpyrazol-4-yl)oxy-1,3,5-triazine
CID 116801169
3-chloro-4-(1-propan-2-ylpyrazol-4-yl)oxy-1,2,5-thiadiazole
CID 116801122
4-bromo-2-(1-propan-2-ylpyrazol-4-yl)oxyaniline
CID 116800549
2,4-difluoro-6-(1-propan-2-ylpyrazol-4-yl)oxyaniline
CID 116800554
2-[2-chloro-6-(1-propan-2-ylpyrazol-4-yl)oxyphenyl]ethanamine
CID 116804277
5-bromo-2-(1-propan-2-ylpyrazol-4-yl)oxybenzenecarbothioamide
CID 114892301
1-[3-chloro-4-(1-propan-2-ylpyrazol-4-yl)oxyphenyl]butan-2-amine
CID 116804291
[5-chloro-6-(1-propan-2-ylpyrazol-4-yl)oxy-3-pyridinyl]methanamine
CID 116803066
(1R)-1-[3-bromo-4-(1-propan-2-ylpyrazol-4-yl)oxyphenyl]ethanamine
CID 104893574
3-amino-5-chloro-6-(1-propan-2-ylpyrazol-4-yl)oxy-1,3-dihydroindol-2-one
CID 116801775

Frequently Asked Questions

What is the IUPAC name of 3,6-dichloro-4-(1-propan-2-ylpyrazol-4-yl)oxypyridazine?
The IUPAC name of 3,6-dichloro-4-(1-propan-2-ylpyrazol-4-yl)oxypyridazine (CID 116801133) is 3,6-dichloro-4-(1-propan-2-ylpyrazol-4-yl)oxypyridazine.
What is the SMILES notation for 3,6-dichloro-4-(1-propan-2-ylpyrazol-4-yl)oxypyridazine?
The canonical SMILES for 3,6-dichloro-4-(1-propan-2-ylpyrazol-4-yl)oxypyridazine is CC(C)n1cc(Oc2cc(Cl)nnc2Cl)cn1.
What is the InChIKey of 3,6-dichloro-4-(1-propan-2-ylpyrazol-4-yl)oxypyridazine?
The InChIKey is MDDQXEFCLTZQOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10Cl2N4O/c1-6(2)16-5-7(4-13-16)17-8-3-9(11)14-15-10(8)12/h3-6H,1-2H3.
What are the key properties of 3,6-dichloro-4-(1-propan-2-ylpyrazol-4-yl)oxypyridazine?
3,6-dichloro-4-(1-propan-2-ylpyrazol-4-yl)oxypyridazine has a molecular weight of 273.12 g/mol, XLogP of 3.35, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-dichloro-4-(1-propan-2-ylpyrazol-4-yl)oxypyridazine is sourced from PubChem (CID 116801133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).