3-bromo-5-(trifluoromethyl)-2H-pyrazolo[3,4-c]pyridine

C7H3BrF3N3 — CID 121232095

IUPAC3-bromo-5-(trifluoromethyl)-2H-pyrazolo[3,4-c]pyridine
SMILESFC(F)(F)c1cc2c(Br)[nH]nc2cn1
InChIInChI=1S/C7H3BrF3N3/c8-6-3-1-5(7(9,10)11)12-2-4(3)13-14-6/h1-2H,(H,13,14)
InChIKeyQFZVZVXPEJVLHJ-UHFFFAOYSA-N
MW266.02 g/mol
LogP2.74
Rot. Bonds

About 3-bromo-5-(trifluoromethyl)-2H-pyrazolo[3,4-c]pyridine

3-bromo-5-(trifluoromethyl)-2H-pyrazolo[3,4-c]pyridine (PubChem CID 121232095) has the molecular formula C7H3BrF3N3 and a molecular weight of 266.02 g/mol. Its IUPAC name is 3-bromo-5-(trifluoromethyl)-2H-pyrazolo[3,4-c]pyridine.

Molecular Properties

Compound Name3-bromo-5-(trifluoromethyl)-2H-pyrazolo[3,4-c]pyridine
PubChem CID121232095
Molecular FormulaC7H3BrF3N3
Molecular Weight266.02 g/mol
Exact Mass264.95
IUPAC Name3-bromo-5-(trifluoromethyl)-2H-pyrazolo[3,4-c]pyridine
SMILESFC(F)(F)c1cc2c(Br)[nH]nc2cn1
InChIInChI=1S/C7H3BrF3N3/c8-6-3-1-5(7(9,10)11)12-2-4(3)13-14-6/h1-2H,(H,13,14)
InChIKeyQFZVZVXPEJVLHJ-UHFFFAOYSA-N
XLogP2.74
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.02
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-bromo-5-(trifluoromethyl)-2H-pyrazolo[3,4-c]pyridine?
The IUPAC name of 3-bromo-5-(trifluoromethyl)-2H-pyrazolo[3,4-c]pyridine (CID 121232095) is 3-bromo-5-(trifluoromethyl)-2H-pyrazolo[3,4-c]pyridine.
What is the SMILES notation for 3-bromo-5-(trifluoromethyl)-2H-pyrazolo[3,4-c]pyridine?
The canonical SMILES for 3-bromo-5-(trifluoromethyl)-2H-pyrazolo[3,4-c]pyridine is FC(F)(F)c1cc2c(Br)[nH]nc2cn1.
What is the InChIKey of 3-bromo-5-(trifluoromethyl)-2H-pyrazolo[3,4-c]pyridine?
The InChIKey is QFZVZVXPEJVLHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H3BrF3N3/c8-6-3-1-5(7(9,10)11)12-2-4(3)13-14-6/h1-2H,(H,13,14).
What are the key properties of 3-bromo-5-(trifluoromethyl)-2H-pyrazolo[3,4-c]pyridine?
3-bromo-5-(trifluoromethyl)-2H-pyrazolo[3,4-c]pyridine has a molecular weight of 266.02 g/mol, XLogP of 2.74, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-5-(trifluoromethyl)-2H-pyrazolo[3,4-c]pyridine is sourced from PubChem (CID 121232095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).