3-(7-chloro-1H-indazol-5-yl)-2,5-bis(difluoromethyl)imidazo[4,5-b]pyridine

C15H8ClF4N5 — CID 122654593

IUPAC3-(7-chloro-1H-indazol-5-yl)-2,5-bis(difluoromethyl)imidazo[4,5-b]pyridine
SMILESFC(F)c1ccc2nc(C(F)F)n(-c3cc(Cl)c4[nH]ncc4c3)c2n1
InChIInChI=1S/C15H8ClF4N5/c16-8-4-7(3-6-5-21-24-11(6)8)25-14-10(23-15(25)13(19)20)2-1-9(22-14)12(17)18/h1-5,12-13H,(H,21,24)
InChIKeyJEJXNLJMWCQGHB-UHFFFAOYSA-N
MW369.71 g/mol
LogP4.83
Rot. Bonds3

About 3-(7-chloro-1H-indazol-5-yl)-2,5-bis(difluoromethyl)imidazo[4,5-b]pyridine

3-(7-chloro-1H-indazol-5-yl)-2,5-bis(difluoromethyl)imidazo[4,5-b]pyridine (PubChem CID 122654593) has the molecular formula C15H8ClF4N5 and a molecular weight of 369.71 g/mol. Its IUPAC name is 3-(7-chloro-1H-indazol-5-yl)-2,5-bis(difluoromethyl)imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name3-(7-chloro-1H-indazol-5-yl)-2,5-bis(difluoromethyl)imidazo[4,5-b]pyridine
PubChem CID122654593
Molecular FormulaC15H8ClF4N5
Molecular Weight369.71 g/mol
Exact Mass369.04
IUPAC Name3-(7-chloro-1H-indazol-5-yl)-2,5-bis(difluoromethyl)imidazo[4,5-b]pyridine
SMILESFC(F)c1ccc2nc(C(F)F)n(-c3cc(Cl)c4[nH]ncc4c3)c2n1
InChIInChI=1S/C15H8ClF4N5/c16-8-4-7(3-6-5-21-24-11(6)8)25-14-10(23-15(25)13(19)20)2-1-9(22-14)12(17)18/h1-5,12-13H,(H,21,24)
InChIKeyJEJXNLJMWCQGHB-UHFFFAOYSA-N
XLogP4.83
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.71
LogP ≤ 54.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(7-chloro-1H-indazol-5-yl)-2,5-bis(difluoromethyl)imidazo[4,5-b]pyridine?
The IUPAC name of 3-(7-chloro-1H-indazol-5-yl)-2,5-bis(difluoromethyl)imidazo[4,5-b]pyridine (CID 122654593) is 3-(7-chloro-1H-indazol-5-yl)-2,5-bis(difluoromethyl)imidazo[4,5-b]pyridine.
What is the SMILES notation for 3-(7-chloro-1H-indazol-5-yl)-2,5-bis(difluoromethyl)imidazo[4,5-b]pyridine?
The canonical SMILES for 3-(7-chloro-1H-indazol-5-yl)-2,5-bis(difluoromethyl)imidazo[4,5-b]pyridine is FC(F)c1ccc2nc(C(F)F)n(-c3cc(Cl)c4[nH]ncc4c3)c2n1.
What is the InChIKey of 3-(7-chloro-1H-indazol-5-yl)-2,5-bis(difluoromethyl)imidazo[4,5-b]pyridine?
The InChIKey is JEJXNLJMWCQGHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H8ClF4N5/c16-8-4-7(3-6-5-21-24-11(6)8)25-14-10(23-15(25)13(19)20)2-1-9(22-14)12(17)18/h1-5,12-13H,(H,21,24).
What are the key properties of 3-(7-chloro-1H-indazol-5-yl)-2,5-bis(difluoromethyl)imidazo[4,5-b]pyridine?
3-(7-chloro-1H-indazol-5-yl)-2,5-bis(difluoromethyl)imidazo[4,5-b]pyridine has a molecular weight of 369.71 g/mol, XLogP of 4.83, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(7-chloro-1H-indazol-5-yl)-2,5-bis(difluoromethyl)imidazo[4,5-b]pyridine is sourced from PubChem (CID 122654593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).