5-bromo-3-chloro-6-fluoro-1-methylpyrazolo[4,3-b]pyridine

C7H4BrClFN3 — CID 178139844

IUPAC5-bromo-3-chloro-6-fluoro-1-methylpyrazolo[4,3-b]pyridine
SMILESCn1nc(Cl)c2nc(Br)c(F)cc21
InChIInChI=1S/C7H4BrClFN3/c1-13-4-2-3(10)6(8)11-5(4)7(9)12-13/h2H,1H3
InChIKeyORBURBJVBFWPQI-UHFFFAOYSA-N
MW264.49 g/mol
LogP2.52
Rot. Bonds

About 5-bromo-3-chloro-6-fluoro-1-methylpyrazolo[4,3-b]pyridine

5-bromo-3-chloro-6-fluoro-1-methylpyrazolo[4,3-b]pyridine (PubChem CID 178139844) has the molecular formula C7H4BrClFN3 and a molecular weight of 264.49 g/mol. Its IUPAC name is 5-bromo-3-chloro-6-fluoro-1-methylpyrazolo[4,3-b]pyridine.

Molecular Properties

Compound Name5-bromo-3-chloro-6-fluoro-1-methylpyrazolo[4,3-b]pyridine
PubChem CID178139844
Molecular FormulaC7H4BrClFN3
Molecular Weight264.49 g/mol
Exact Mass262.93
IUPAC Name5-bromo-3-chloro-6-fluoro-1-methylpyrazolo[4,3-b]pyridine
SMILESCn1nc(Cl)c2nc(Br)c(F)cc21
InChIInChI=1S/C7H4BrClFN3/c1-13-4-2-3(10)6(8)11-5(4)7(9)12-13/h2H,1H3
InChIKeyORBURBJVBFWPQI-UHFFFAOYSA-N
XLogP2.52
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.49
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

6-bromo-3-chloro-1-methylpyrazolo[4,3-b]pyridine
CID 84728732
3,5-dichloro-6-methoxy-1-methylpyrazolo[4,3-b]pyridine
CID 178139480
2-bromo-6-chloro-3-fluoro-5-methylpyridine
CID 130114370
6-fluoro-3-methoxy-1,5-dimethylpyrazolo[4,3-b]pyridine
CID 178139826
3-bromo-1-methylpyrazolo[4,3-b]pyridin-6-amine
CID 84725904
6-bromo-4-fluoro-1,3-dimethylindazole;ethane
CID 176567002
2-bromo-5-chloro-6-(difluoromethyl)-3-fluoropyridine
CID 118997697
(2,5-dibromo-6-fluoropyrrolo[3,2-b]pyridin-1-yl) thiohypofluorite
CID 178060639
8-bromo-2-chloro-3-ethyl-6-fluoroquinoline
CID 63231922
5,6-difluoro-1-methylindazole
CID 159529872
8-bromo-4-chloro-6-fluoro-[1,2,4]triazolo[4,3-a]quinoxaline
CID 58476034
2,3-dibromo-5,8-difluoroquinoxaline
CID 125451989

Frequently Asked Questions

What is the IUPAC name of 5-bromo-3-chloro-6-fluoro-1-methylpyrazolo[4,3-b]pyridine?
The IUPAC name of 5-bromo-3-chloro-6-fluoro-1-methylpyrazolo[4,3-b]pyridine (CID 178139844) is 5-bromo-3-chloro-6-fluoro-1-methylpyrazolo[4,3-b]pyridine.
What is the SMILES notation for 5-bromo-3-chloro-6-fluoro-1-methylpyrazolo[4,3-b]pyridine?
The canonical SMILES for 5-bromo-3-chloro-6-fluoro-1-methylpyrazolo[4,3-b]pyridine is Cn1nc(Cl)c2nc(Br)c(F)cc21.
What is the InChIKey of 5-bromo-3-chloro-6-fluoro-1-methylpyrazolo[4,3-b]pyridine?
The InChIKey is ORBURBJVBFWPQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4BrClFN3/c1-13-4-2-3(10)6(8)11-5(4)7(9)12-13/h2H,1H3.
What are the key properties of 5-bromo-3-chloro-6-fluoro-1-methylpyrazolo[4,3-b]pyridine?
5-bromo-3-chloro-6-fluoro-1-methylpyrazolo[4,3-b]pyridine has a molecular weight of 264.49 g/mol, XLogP of 2.52, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-3-chloro-6-fluoro-1-methylpyrazolo[4,3-b]pyridine is sourced from PubChem (CID 178139844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).