4-(2,6-difluorophenyl)-5-(3,5-dimethoxyphenyl)-3-fluoro-6-methylpyridazine

C19H15F3N2O2 — CID 66926845

IUPAC4-(2,6-difluorophenyl)-5-(3,5-dimethoxyphenyl)-3-fluoro-6-methylpyridazine
SMILESCOc1cc(OC)cc(-c2c(C)nnc(F)c2-c2c(F)cccc2F)c1
InChIInChI=1S/C19H15F3N2O2/c1-10-16(11-7-12(25-2)9-13(8-11)26-3)18(19(22)24-23-10)17-14(20)5-4-6-15(17)21/h4-9H,1-3H3
InChIKeyHTIYUVJYVDTDCJ-UHFFFAOYSA-N
MW360.34 g/mol
LogP4.55
Rot. Bonds4

About 4-(2,6-difluorophenyl)-5-(3,5-dimethoxyphenyl)-3-fluoro-6-methylpyridazine

4-(2,6-difluorophenyl)-5-(3,5-dimethoxyphenyl)-3-fluoro-6-methylpyridazine (PubChem CID 66926845) has the molecular formula C19H15F3N2O2 and a molecular weight of 360.34 g/mol. Its IUPAC name is 4-(2,6-difluorophenyl)-5-(3,5-dimethoxyphenyl)-3-fluoro-6-methylpyridazine.

Molecular Properties

Compound Name4-(2,6-difluorophenyl)-5-(3,5-dimethoxyphenyl)-3-fluoro-6-methylpyridazine
PubChem CID66926845
Molecular FormulaC19H15F3N2O2
Molecular Weight360.34 g/mol
Exact Mass360.11
IUPAC Name4-(2,6-difluorophenyl)-5-(3,5-dimethoxyphenyl)-3-fluoro-6-methylpyridazine
SMILESCOc1cc(OC)cc(-c2c(C)nnc(F)c2-c2c(F)cccc2F)c1
InChIInChI=1S/C19H15F3N2O2/c1-10-16(11-7-12(25-2)9-13(8-11)26-3)18(19(22)24-23-10)17-14(20)5-4-6-15(17)21/h4-9H,1-3H3
InChIKeyHTIYUVJYVDTDCJ-UHFFFAOYSA-N
XLogP4.55
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.34
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,6-difluorophenyl)-1,3,5-trimethoxybenzene
CID 175990083
4-chloro-5-(2,6-difluorophenyl)-6-(3,5-dimethoxyphenyl)-2-methylpyrimidine
CID 167474381
2-[6-chloro-5-(2,6-difluorophenyl)-4-(3,5-dimethoxyphenyl)pyridazin-3-yl]acetonitrile
CID 86665919
3-chloro-4-(2,6-difluoro-4-methoxyphenyl)-5-(4-ethynylphenyl)-6-methylpyridazine
CID 87371063
3-[4-[5-(3,5-dimethoxyphenyl)-6-(2-fluorophenyl)-3-methylpyridazin-4-yl]-3,5-difluorophenoxy]-N-methylpropan-1-amine
CID 67223121
3-(2,6-difluorophenyl)-5-methoxybenzoic acid
CID 53225965
4-chloro-5-(2,6-difluorophenyl)-6-(3,5-dimethoxyphenyl)-2-methylpyridazin-3-one
CID 165389177
4-(3,5-dimethoxyphenyl)-3-(4-fluorophenyl)-2-methyl-5-propan-2-ylpyridine
CID 67076023
1-[4-(3,5-dimethoxyphenyl)phenyl]-3,5-dimethoxybenzene
CID 139197183
1,4-bis(3,5-dimethoxyphenyl)-2,3,5,6-tetraphenylbenzene
CID 102293642
9,10-bis(3,5-dimethoxyphenyl)anthracene
CID 11961931
2-(3,5-dimethoxyphenyl)-4-fluoro-1H-benzimidazole
CID 60977992

Frequently Asked Questions

What is the IUPAC name of 4-(2,6-difluorophenyl)-5-(3,5-dimethoxyphenyl)-3-fluoro-6-methylpyridazine?
The IUPAC name of 4-(2,6-difluorophenyl)-5-(3,5-dimethoxyphenyl)-3-fluoro-6-methylpyridazine (CID 66926845) is 4-(2,6-difluorophenyl)-5-(3,5-dimethoxyphenyl)-3-fluoro-6-methylpyridazine.
What is the SMILES notation for 4-(2,6-difluorophenyl)-5-(3,5-dimethoxyphenyl)-3-fluoro-6-methylpyridazine?
The canonical SMILES for 4-(2,6-difluorophenyl)-5-(3,5-dimethoxyphenyl)-3-fluoro-6-methylpyridazine is COc1cc(OC)cc(-c2c(C)nnc(F)c2-c2c(F)cccc2F)c1.
What is the InChIKey of 4-(2,6-difluorophenyl)-5-(3,5-dimethoxyphenyl)-3-fluoro-6-methylpyridazine?
The InChIKey is HTIYUVJYVDTDCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15F3N2O2/c1-10-16(11-7-12(25-2)9-13(8-11)26-3)18(19(22)24-23-10)17-14(20)5-4-6-15(17)21/h4-9H,1-3H3.
What are the key properties of 4-(2,6-difluorophenyl)-5-(3,5-dimethoxyphenyl)-3-fluoro-6-methylpyridazine?
4-(2,6-difluorophenyl)-5-(3,5-dimethoxyphenyl)-3-fluoro-6-methylpyridazine has a molecular weight of 360.34 g/mol, XLogP of 4.55, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,6-difluorophenyl)-5-(3,5-dimethoxyphenyl)-3-fluoro-6-methylpyridazine is sourced from PubChem (CID 66926845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).