4-phenyl-6-(trifluoromethyl)-1H-indazole

C14H9F3N2 — CID 71735205

IUPAC4-phenyl-6-(trifluoromethyl)-1H-indazole
SMILESFC(F)(F)c1cc(-c2ccccc2)c2cn[nH]c2c1
InChIInChI=1S/C14H9F3N2/c15-14(16,17)10-6-11(9-4-2-1-3-5-9)12-8-18-19-13(12)7-10/h1-8H,(H,18,19)
InChIKeyORZCBQVVROFUNM-UHFFFAOYSA-N
MW262.23 g/mol
LogP4.25
Rot. Bonds1

About 4-phenyl-6-(trifluoromethyl)-1H-indazole

4-phenyl-6-(trifluoromethyl)-1H-indazole (PubChem CID 71735205) has the molecular formula C14H9F3N2 and a molecular weight of 262.23 g/mol. Its IUPAC name is 4-phenyl-6-(trifluoromethyl)-1H-indazole.

Molecular Properties

Compound Name4-phenyl-6-(trifluoromethyl)-1H-indazole
PubChem CID71735205
Molecular FormulaC14H9F3N2
Molecular Weight262.23 g/mol
Exact Mass262.07
IUPAC Name4-phenyl-6-(trifluoromethyl)-1H-indazole
SMILESFC(F)(F)c1cc(-c2ccccc2)c2cn[nH]c2c1
InChIInChI=1S/C14H9F3N2/c15-14(16,17)10-6-11(9-4-2-1-3-5-9)12-8-18-19-13(12)7-10/h1-8H,(H,18,19)
InChIKeyORZCBQVVROFUNM-UHFFFAOYSA-N
XLogP4.25
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.23
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1H-Indazol-5-amine
CID 88012
1H-Indazole
CID 9221
6-(trifluoromethyl)-1H-indazole
CID 21455599
7-Methyl-1H-indazole
CID 820797
4-Methyl-1H-indazole
CID 820806
3-(naphthalen-1-yl)-1H-pyrazole
CID 2737035
4-(3-methylpyridin-4-yl)-6-(trifluoromethyl)-1H-indazole
CID 71735206
6-Methyl-1H-indazole
CID 12639191
4-(1H-indazol-6-yl)-2-methyl-3,4-dihydro-1H-isoquinoline
CID 11687579
4-(2-methylpyrazol-3-yl)-6-(trifluoromethyl)-1H-indazole
CID 71735375
4-(3-fluoropyridin-4-yl)-6-(trifluoromethyl)-1H-indazole
CID 89783285
5-[2-(trifluoromethyl)phenyl]-1H-indazole
CID 90645447

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-6-(trifluoromethyl)-1H-indazole?
The IUPAC name of 4-phenyl-6-(trifluoromethyl)-1H-indazole (CID 71735205) is 4-phenyl-6-(trifluoromethyl)-1H-indazole.
What is the SMILES notation for 4-phenyl-6-(trifluoromethyl)-1H-indazole?
The canonical SMILES for 4-phenyl-6-(trifluoromethyl)-1H-indazole is FC(F)(F)c1cc(-c2ccccc2)c2cn[nH]c2c1.
What is the InChIKey of 4-phenyl-6-(trifluoromethyl)-1H-indazole?
The InChIKey is ORZCBQVVROFUNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9F3N2/c15-14(16,17)10-6-11(9-4-2-1-3-5-9)12-8-18-19-13(12)7-10/h1-8H,(H,18,19).
What are the key properties of 4-phenyl-6-(trifluoromethyl)-1H-indazole?
4-phenyl-6-(trifluoromethyl)-1H-indazole has a molecular weight of 262.23 g/mol, XLogP of 4.25, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-6-(trifluoromethyl)-1H-indazole is sourced from PubChem (CID 71735205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).