4-(2-methoxyphenyl)-3-[3-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-c]pyridine

C20H14F3N3O — CID 71448705

IUPAC4-(2-methoxyphenyl)-3-[3-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-c]pyridine
SMILESCOc1ccccc1-c1nccc2[nH]nc(-c3cccc(C(F)(F)F)c3)c12
InChIInChI=1S/C20H14F3N3O/c1-27-16-8-3-2-7-14(16)19-17-15(9-10-24-19)25-26-18(17)12-5-4-6-13(11-12)20(21,22)23/h2-11H,1H3,(H,25,26)
InChIKeyVBLJIHYYJGYDNK-UHFFFAOYSA-N
MW369.35 g/mol
LogP5.32
Rot. Bonds3

About 4-(2-methoxyphenyl)-3-[3-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-c]pyridine

4-(2-methoxyphenyl)-3-[3-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-c]pyridine (PubChem CID 71448705) has the molecular formula C20H14F3N3O and a molecular weight of 369.35 g/mol. Its IUPAC name is 4-(2-methoxyphenyl)-3-[3-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-c]pyridine.

Molecular Properties

Compound Name4-(2-methoxyphenyl)-3-[3-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-c]pyridine
PubChem CID71448705
Molecular FormulaC20H14F3N3O
Molecular Weight369.35 g/mol
Exact Mass369.11
IUPAC Name4-(2-methoxyphenyl)-3-[3-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-c]pyridine
SMILESCOc1ccccc1-c1nccc2[nH]nc(-c3cccc(C(F)(F)F)c3)c12
InChIInChI=1S/C20H14F3N3O/c1-27-16-8-3-2-7-14(16)19-17-15(9-10-24-19)25-26-18(17)12-5-4-6-13(11-12)20(21,22)23/h2-11H,1H3,(H,25,26)
InChIKeyVBLJIHYYJGYDNK-UHFFFAOYSA-N
XLogP5.32
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500369.35
LogP ≤ 55.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-(2-methoxyphenyl)-3-[3-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-c]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxyphenyl)-3-[3-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-c]pyridine?
The IUPAC name of 4-(2-methoxyphenyl)-3-[3-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-c]pyridine (CID 71448705) is 4-(2-methoxyphenyl)-3-[3-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-c]pyridine.
What is the SMILES notation for 4-(2-methoxyphenyl)-3-[3-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-c]pyridine?
The canonical SMILES for 4-(2-methoxyphenyl)-3-[3-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-c]pyridine is COc1ccccc1-c1nccc2[nH]nc(-c3cccc(C(F)(F)F)c3)c12.
What is the InChIKey of 4-(2-methoxyphenyl)-3-[3-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-c]pyridine?
The InChIKey is VBLJIHYYJGYDNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14F3N3O/c1-27-16-8-3-2-7-14(16)19-17-15(9-10-24-19)25-26-18(17)12-5-4-6-13(11-12)20(21,22)23/h2-11H,1H3,(H,25,26).
What are the key properties of 4-(2-methoxyphenyl)-3-[3-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-c]pyridine?
4-(2-methoxyphenyl)-3-[3-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-c]pyridine has a molecular weight of 369.35 g/mol, XLogP of 5.32, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxyphenyl)-3-[3-(trifluoromethyl)phenyl]-1H-pyrazolo[4,3-c]pyridine is sourced from PubChem (CID 71448705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).