7-fluoro-4-(3-fluoro-4-methylphenyl)-2-methylindazole

C15H12F2N2 — CID 166076510

IUPAC7-fluoro-4-(3-fluoro-4-methylphenyl)-2-methylindazole
SMILESCc1ccc(-c2ccc(F)c3nn(C)cc23)cc1F
InChIInChI=1S/C15H12F2N2/c1-9-3-4-10(7-14(9)17)11-5-6-13(16)15-12(11)8-19(2)18-15/h3-8H,1-2H3
InChIKeyAPKWMTCWPVKFFC-UHFFFAOYSA-N
MW258.27 g/mol
LogP3.83
Rot. Bonds1

About 7-fluoro-4-(3-fluoro-4-methylphenyl)-2-methylindazole

7-fluoro-4-(3-fluoro-4-methylphenyl)-2-methylindazole (PubChem CID 166076510) has the molecular formula C15H12F2N2 and a molecular weight of 258.27 g/mol. Its IUPAC name is 7-fluoro-4-(3-fluoro-4-methylphenyl)-2-methylindazole.

Molecular Properties

Compound Name7-fluoro-4-(3-fluoro-4-methylphenyl)-2-methylindazole
PubChem CID166076510
Molecular FormulaC15H12F2N2
Molecular Weight258.27 g/mol
Exact Mass258.10
IUPAC Name7-fluoro-4-(3-fluoro-4-methylphenyl)-2-methylindazole
SMILESCc1ccc(-c2ccc(F)c3nn(C)cc23)cc1F
InChIInChI=1S/C15H12F2N2/c1-9-3-4-10(7-14(9)17)11-5-6-13(16)15-12(11)8-19(2)18-15/h3-8H,1-2H3
InChIKeyAPKWMTCWPVKFFC-UHFFFAOYSA-N
XLogP3.83
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.27
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(3,5-difluoro-4-methylphenyl)-2,7-dimethylindazole
CID 166076690
5-(3-fluoro-4-methylphenyl)-2,6-dimethylindazole;propane
CID 166076712
7,7-dideuterio-6-[[4-(2,7-dimethylindazol-4-yl)-2-fluorophenyl]methyl]pyrrolo[3,4-b]pyridin-5-one
CID 171760346
6-(3-fluoro-4-methylphenyl)-2-methylindazole;propane
CID 166076580
6,7-difluoro-2,4-dimethylindazole
CID 166076527
4-(3-fluoro-4-methylphenyl)-1,5-dimethylpyrazole
CID 121385904
4-[4-(3,5-difluoro-4-methylphenyl)-2-methylindazol-7-yl]oxan-4-ol
CID 171528499
2-[4-(3-cyclopropyl-5-fluoro-4-methylphenyl)-2-methylindazol-7-yl]propan-2-ol
CID 171528198
1-(4-chlorophenyl)-3-(3-fluoro-4-methylphenyl)pyrazol-4-amine
CID 83203236
8-fluoro-5-(3-fluoro-4-methylphenyl)-3H-quinazolin-4-one
CID 142278595
5-(3-fluoro-4-methylphenyl)-1,3-dimethylpyrazole
CID 155276309
7-chloro-6-fluoro-2,4-dimethylindazole
CID 166076486

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-4-(3-fluoro-4-methylphenyl)-2-methylindazole?
The IUPAC name of 7-fluoro-4-(3-fluoro-4-methylphenyl)-2-methylindazole (CID 166076510) is 7-fluoro-4-(3-fluoro-4-methylphenyl)-2-methylindazole.
What is the SMILES notation for 7-fluoro-4-(3-fluoro-4-methylphenyl)-2-methylindazole?
The canonical SMILES for 7-fluoro-4-(3-fluoro-4-methylphenyl)-2-methylindazole is Cc1ccc(-c2ccc(F)c3nn(C)cc23)cc1F.
What is the InChIKey of 7-fluoro-4-(3-fluoro-4-methylphenyl)-2-methylindazole?
The InChIKey is APKWMTCWPVKFFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12F2N2/c1-9-3-4-10(7-14(9)17)11-5-6-13(16)15-12(11)8-19(2)18-15/h3-8H,1-2H3.
What are the key properties of 7-fluoro-4-(3-fluoro-4-methylphenyl)-2-methylindazole?
7-fluoro-4-(3-fluoro-4-methylphenyl)-2-methylindazole has a molecular weight of 258.27 g/mol, XLogP of 3.83, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-4-(3-fluoro-4-methylphenyl)-2-methylindazole is sourced from PubChem (CID 166076510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).