7-methyl-3-(7-methyl-1H-indazol-5-yl)-2-(trifluoromethyl)imidazo[4,5-b]pyridine

C16H12F3N5 — CID 122654595

IUPAC7-methyl-3-(7-methyl-1H-indazol-5-yl)-2-(trifluoromethyl)imidazo[4,5-b]pyridine
SMILESCc1ccnc2c1nc(C(F)(F)F)n2-c1cc(C)c2[nH]ncc2c1
InChIInChI=1S/C16H12F3N5/c1-8-3-4-20-14-13(8)22-15(16(17,18)19)24(14)11-5-9(2)12-10(6-11)7-21-23-12/h3-7H,1-2H3,(H,21,23)
InChIKeyQPKAOMKSPAZAER-UHFFFAOYSA-N
MW331.30 g/mol
LogP3.93
Rot. Bonds1

About 7-methyl-3-(7-methyl-1H-indazol-5-yl)-2-(trifluoromethyl)imidazo[4,5-b]pyridine

7-methyl-3-(7-methyl-1H-indazol-5-yl)-2-(trifluoromethyl)imidazo[4,5-b]pyridine (PubChem CID 122654595) has the molecular formula C16H12F3N5 and a molecular weight of 331.30 g/mol. Its IUPAC name is 7-methyl-3-(7-methyl-1H-indazol-5-yl)-2-(trifluoromethyl)imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name7-methyl-3-(7-methyl-1H-indazol-5-yl)-2-(trifluoromethyl)imidazo[4,5-b]pyridine
PubChem CID122654595
Molecular FormulaC16H12F3N5
Molecular Weight331.30 g/mol
Exact Mass331.10
IUPAC Name7-methyl-3-(7-methyl-1H-indazol-5-yl)-2-(trifluoromethyl)imidazo[4,5-b]pyridine
SMILESCc1ccnc2c1nc(C(F)(F)F)n2-c1cc(C)c2[nH]ncc2c1
InChIInChI=1S/C16H12F3N5/c1-8-3-4-20-14-13(8)22-15(16(17,18)19)24(14)11-5-9(2)12-10(6-11)7-21-23-12/h3-7H,1-2H3,(H,21,23)
InChIKeyQPKAOMKSPAZAER-UHFFFAOYSA-N
XLogP3.93
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.30
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 7-methyl-3-(7-methyl-1H-indazol-5-yl)-2-(trifluoromethyl)imidazo[4,5-b]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 7-methyl-3-(7-methyl-1H-indazol-5-yl)-2-(trifluoromethyl)imidazo[4,5-b]pyridine?
The IUPAC name of 7-methyl-3-(7-methyl-1H-indazol-5-yl)-2-(trifluoromethyl)imidazo[4,5-b]pyridine (CID 122654595) is 7-methyl-3-(7-methyl-1H-indazol-5-yl)-2-(trifluoromethyl)imidazo[4,5-b]pyridine.
What is the SMILES notation for 7-methyl-3-(7-methyl-1H-indazol-5-yl)-2-(trifluoromethyl)imidazo[4,5-b]pyridine?
The canonical SMILES for 7-methyl-3-(7-methyl-1H-indazol-5-yl)-2-(trifluoromethyl)imidazo[4,5-b]pyridine is Cc1ccnc2c1nc(C(F)(F)F)n2-c1cc(C)c2[nH]ncc2c1.
What is the InChIKey of 7-methyl-3-(7-methyl-1H-indazol-5-yl)-2-(trifluoromethyl)imidazo[4,5-b]pyridine?
The InChIKey is QPKAOMKSPAZAER-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12F3N5/c1-8-3-4-20-14-13(8)22-15(16(17,18)19)24(14)11-5-9(2)12-10(6-11)7-21-23-12/h3-7H,1-2H3,(H,21,23).
What are the key properties of 7-methyl-3-(7-methyl-1H-indazol-5-yl)-2-(trifluoromethyl)imidazo[4,5-b]pyridine?
7-methyl-3-(7-methyl-1H-indazol-5-yl)-2-(trifluoromethyl)imidazo[4,5-b]pyridine has a molecular weight of 331.30 g/mol, XLogP of 3.93, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-3-(7-methyl-1H-indazol-5-yl)-2-(trifluoromethyl)imidazo[4,5-b]pyridine is sourced from PubChem (CID 122654595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).