3-cyclopentyl-6-(2,4-difluorophenoxy)-2H-pyrazolo[4,3-c]pyridine

C17H15F2N3O — CID 58956260

IUPAC3-cyclopentyl-6-(2,4-difluorophenoxy)-2H-pyrazolo[4,3-c]pyridine
SMILESFc1ccc(Oc2cc3n[nH]c(C4CCCC4)c3cn2)c(F)c1
InChIInChI=1S/C17H15F2N3O/c18-11-5-6-15(13(19)7-11)23-16-8-14-12(9-20-16)17(22-21-14)10-3-1-2-4-10/h5-10H,1-4H2,(H,21,22)
InChIKeyFBGTURMJHRXPOA-UHFFFAOYSA-N
MW315.32 g/mol
LogP4.69
Rot. Bonds3

About 3-cyclopentyl-6-(2,4-difluorophenoxy)-2H-pyrazolo[4,3-c]pyridine

3-cyclopentyl-6-(2,4-difluorophenoxy)-2H-pyrazolo[4,3-c]pyridine (PubChem CID 58956260) has the molecular formula C17H15F2N3O and a molecular weight of 315.32 g/mol. Its IUPAC name is 3-cyclopentyl-6-(2,4-difluorophenoxy)-2H-pyrazolo[4,3-c]pyridine.

Molecular Properties

Compound Name3-cyclopentyl-6-(2,4-difluorophenoxy)-2H-pyrazolo[4,3-c]pyridine
PubChem CID58956260
Molecular FormulaC17H15F2N3O
Molecular Weight315.32 g/mol
Exact Mass315.12
IUPAC Name3-cyclopentyl-6-(2,4-difluorophenoxy)-2H-pyrazolo[4,3-c]pyridine
SMILESFc1ccc(Oc2cc3n[nH]c(C4CCCC4)c3cn2)c(F)c1
InChIInChI=1S/C17H15F2N3O/c18-11-5-6-15(13(19)7-11)23-16-8-14-12(9-20-16)17(22-21-14)10-3-1-2-4-10/h5-10H,1-4H2,(H,21,22)
InChIKeyFBGTURMJHRXPOA-UHFFFAOYSA-N
XLogP4.69
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.32
LogP ≤ 54.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-6-(2,4-difluorophenoxy)-2H-pyrazolo[4,3-c]pyridine?
The IUPAC name of 3-cyclopentyl-6-(2,4-difluorophenoxy)-2H-pyrazolo[4,3-c]pyridine (CID 58956260) is 3-cyclopentyl-6-(2,4-difluorophenoxy)-2H-pyrazolo[4,3-c]pyridine.
What is the SMILES notation for 3-cyclopentyl-6-(2,4-difluorophenoxy)-2H-pyrazolo[4,3-c]pyridine?
The canonical SMILES for 3-cyclopentyl-6-(2,4-difluorophenoxy)-2H-pyrazolo[4,3-c]pyridine is Fc1ccc(Oc2cc3n[nH]c(C4CCCC4)c3cn2)c(F)c1.
What is the InChIKey of 3-cyclopentyl-6-(2,4-difluorophenoxy)-2H-pyrazolo[4,3-c]pyridine?
The InChIKey is FBGTURMJHRXPOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15F2N3O/c18-11-5-6-15(13(19)7-11)23-16-8-14-12(9-20-16)17(22-21-14)10-3-1-2-4-10/h5-10H,1-4H2,(H,21,22).
What are the key properties of 3-cyclopentyl-6-(2,4-difluorophenoxy)-2H-pyrazolo[4,3-c]pyridine?
3-cyclopentyl-6-(2,4-difluorophenoxy)-2H-pyrazolo[4,3-c]pyridine has a molecular weight of 315.32 g/mol, XLogP of 4.69, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-6-(2,4-difluorophenoxy)-2H-pyrazolo[4,3-c]pyridine is sourced from PubChem (CID 58956260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).