[6-[4-(difluoromethoxy)-3-methoxyphenyl]pyridazin-3-yl]oxy-trimethylsilane

C15H18F2N2O3Si — CID 91742628

IUPAC[6-[4-(difluoromethoxy)-3-methoxyphenyl]pyridazin-3-yl]oxy-trimethylsilane
SMILESCOc1cc(-c2ccc(O[Si](C)(C)C)nn2)ccc1OC(F)F
InChIInChI=1S/C15H18F2N2O3Si/c1-20-13-9-10(5-7-12(13)21-15(16)17)11-6-8-14(19-18-11)22-23(2,3)4/h5-9,15H,1-4H3
InChIKeyFTWHWAJBMROVCP-UHFFFAOYSA-N
MW340.40 g/mol
LogP3.97
Rot. Bonds6

About [6-[4-(difluoromethoxy)-3-methoxyphenyl]pyridazin-3-yl]oxy-trimethylsilane

[6-[4-(difluoromethoxy)-3-methoxyphenyl]pyridazin-3-yl]oxy-trimethylsilane (PubChem CID 91742628) has the molecular formula C15H18F2N2O3Si and a molecular weight of 340.40 g/mol. Its IUPAC name is [6-[4-(difluoromethoxy)-3-methoxyphenyl]pyridazin-3-yl]oxy-trimethylsilane.

Molecular Properties

Compound Name[6-[4-(difluoromethoxy)-3-methoxyphenyl]pyridazin-3-yl]oxy-trimethylsilane
PubChem CID91742628
Molecular FormulaC15H18F2N2O3Si
Molecular Weight340.40 g/mol
Exact Mass340.11
IUPAC Name[6-[4-(difluoromethoxy)-3-methoxyphenyl]pyridazin-3-yl]oxy-trimethylsilane
SMILESCOc1cc(-c2ccc(O[Si](C)(C)C)nn2)ccc1OC(F)F
InChIInChI=1S/C15H18F2N2O3Si/c1-20-13-9-10(5-7-12(13)21-15(16)17)11-6-8-14(19-18-11)22-23(2,3)4/h5-9,15H,1-4H3
InChIKeyFTWHWAJBMROVCP-UHFFFAOYSA-N
XLogP3.97
TPSA53.47 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.40
LogP ≤ 53.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

N-benzyl-6-[4-(difluoromethoxy)-3-methoxyphenyl]pyridazin-3-amine
CID 19385488
2-[4-(difluoromethoxy)-3-methoxyphenyl]-5-(4-methylphenyl)-1,3,4-oxadiazole
CID 19554615
2-[4-(difluoromethoxy)-3-methoxyphenyl]-5-[1-(difluoromethyl)pyrazol-3-yl]-1,3,4-oxadiazole
CID 19552582
6-(3,4-dimethoxyphenyl)-N-methylpyridazin-3-amine
CID 62203035
2-[4-(difluoromethoxy)-3-methoxyphenyl]-5-(2-fluorophenyl)-1,3,4-oxadiazole
CID 19554513
5-[4-(difluoromethoxy)-3-methoxyphenyl]-3-(4-fluorophenyl)-1,2,4-oxadiazole
CID 19326293
[6-(3,4-dimethoxyphenyl)pyridazin-3-yl] 3,4,5-trimethoxybenzoate
CID 6418724
6-(3,4-dimethoxyphenyl)pyridazine-3-carbaldehyde
CID 82294072
3-(3,4-dichlorophenyl)-6-methoxypyridazine
CID 12833133
3-[3-[4-(difluoromethoxy)-3-methoxyphenyl]-1,2,4-oxadiazol-5-yl]butan-2-amine
CID 120835627
4-chloro-2-[3-(difluoromethoxy)-4-methoxyphenyl]-5,6-dimethylpyrimidine
CID 60996659
2-[4-(difluoromethoxy)-3-methoxyphenyl]-5-[(4-methoxyphenyl)methyl]-1,3,4-oxadiazole
CID 19550804

Frequently Asked Questions

What is the IUPAC name of [6-[4-(difluoromethoxy)-3-methoxyphenyl]pyridazin-3-yl]oxy-trimethylsilane?
The IUPAC name of [6-[4-(difluoromethoxy)-3-methoxyphenyl]pyridazin-3-yl]oxy-trimethylsilane (CID 91742628) is [6-[4-(difluoromethoxy)-3-methoxyphenyl]pyridazin-3-yl]oxy-trimethylsilane.
What is the SMILES notation for [6-[4-(difluoromethoxy)-3-methoxyphenyl]pyridazin-3-yl]oxy-trimethylsilane?
The canonical SMILES for [6-[4-(difluoromethoxy)-3-methoxyphenyl]pyridazin-3-yl]oxy-trimethylsilane is COc1cc(-c2ccc(O[Si](C)(C)C)nn2)ccc1OC(F)F.
What is the InChIKey of [6-[4-(difluoromethoxy)-3-methoxyphenyl]pyridazin-3-yl]oxy-trimethylsilane?
The InChIKey is FTWHWAJBMROVCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18F2N2O3Si/c1-20-13-9-10(5-7-12(13)21-15(16)17)11-6-8-14(19-18-11)22-23(2,3)4/h5-9,15H,1-4H3.
What are the key properties of [6-[4-(difluoromethoxy)-3-methoxyphenyl]pyridazin-3-yl]oxy-trimethylsilane?
[6-[4-(difluoromethoxy)-3-methoxyphenyl]pyridazin-3-yl]oxy-trimethylsilane has a molecular weight of 340.40 g/mol, XLogP of 3.97, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[4-(difluoromethoxy)-3-methoxyphenyl]pyridazin-3-yl]oxy-trimethylsilane is sourced from PubChem (CID 91742628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).