4-bromo-6-(2-fluoroethoxy)pyrazolo[1,5-a]pyridine-3-carbonitrile

C10H7BrFN3O — CID 156894931

IUPAC4-bromo-6-(2-fluoroethoxy)pyrazolo[1,5-a]pyridine-3-carbonitrile
SMILESN#Cc1cnn2cc(OCCF)cc(Br)c12
InChIInChI=1S/C10H7BrFN3O/c11-9-3-8(16-2-1-12)6-15-10(9)7(4-13)5-14-15/h3,5-6H,1-2H2
InChIKeyUSEAQBXOSQHSLH-UHFFFAOYSA-N
MW284.09 g/mol
LogP2.32
Rot. Bonds3

About 4-bromo-6-(2-fluoroethoxy)pyrazolo[1,5-a]pyridine-3-carbonitrile

4-bromo-6-(2-fluoroethoxy)pyrazolo[1,5-a]pyridine-3-carbonitrile (PubChem CID 156894931) has the molecular formula C10H7BrFN3O and a molecular weight of 284.09 g/mol. Its IUPAC name is 4-bromo-6-(2-fluoroethoxy)pyrazolo[1,5-a]pyridine-3-carbonitrile.

Molecular Properties

Compound Name4-bromo-6-(2-fluoroethoxy)pyrazolo[1,5-a]pyridine-3-carbonitrile
PubChem CID156894931
Molecular FormulaC10H7BrFN3O
Molecular Weight284.09 g/mol
Exact Mass282.98
IUPAC Name4-bromo-6-(2-fluoroethoxy)pyrazolo[1,5-a]pyridine-3-carbonitrile
SMILESN#Cc1cnn2cc(OCCF)cc(Br)c12
InChIInChI=1S/C10H7BrFN3O/c11-9-3-8(16-2-1-12)6-15-10(9)7(4-13)5-14-15/h3,5-6H,1-2H2
InChIKeyUSEAQBXOSQHSLH-UHFFFAOYSA-N
XLogP2.32
TPSA50.32 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.09
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-bromo-6-(2-fluoroethoxy)pyrazolo[1,5-a]pyridine-3-carbonitrile?
The IUPAC name of 4-bromo-6-(2-fluoroethoxy)pyrazolo[1,5-a]pyridine-3-carbonitrile (CID 156894931) is 4-bromo-6-(2-fluoroethoxy)pyrazolo[1,5-a]pyridine-3-carbonitrile.
What is the SMILES notation for 4-bromo-6-(2-fluoroethoxy)pyrazolo[1,5-a]pyridine-3-carbonitrile?
The canonical SMILES for 4-bromo-6-(2-fluoroethoxy)pyrazolo[1,5-a]pyridine-3-carbonitrile is N#Cc1cnn2cc(OCCF)cc(Br)c12.
What is the InChIKey of 4-bromo-6-(2-fluoroethoxy)pyrazolo[1,5-a]pyridine-3-carbonitrile?
The InChIKey is USEAQBXOSQHSLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7BrFN3O/c11-9-3-8(16-2-1-12)6-15-10(9)7(4-13)5-14-15/h3,5-6H,1-2H2.
What are the key properties of 4-bromo-6-(2-fluoroethoxy)pyrazolo[1,5-a]pyridine-3-carbonitrile?
4-bromo-6-(2-fluoroethoxy)pyrazolo[1,5-a]pyridine-3-carbonitrile has a molecular weight of 284.09 g/mol, XLogP of 2.32, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-6-(2-fluoroethoxy)pyrazolo[1,5-a]pyridine-3-carbonitrile is sourced from PubChem (CID 156894931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).