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

C10H8BrN3O2 — CID 134434816

IUPAC4-bromo-6-(2-hydroxyethoxy)pyrazolo[1,5-a]pyridine-3-carbonitrile
SMILESN#Cc1cnn2cc(OCCO)cc(Br)c12
InChIInChI=1S/C10H8BrN3O2/c11-9-3-8(16-2-1-15)6-14-10(9)7(4-12)5-13-14/h3,5-6,15H,1-2H2
InChIKeyIKVUIGSZDHIXBE-UHFFFAOYSA-N
MW282.10 g/mol
LogP1.34
Rot. Bonds3

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

4-bromo-6-(2-hydroxyethoxy)pyrazolo[1,5-a]pyridine-3-carbonitrile (PubChem CID 134434816) has the molecular formula C10H8BrN3O2 and a molecular weight of 282.10 g/mol. Its IUPAC name is 4-bromo-6-(2-hydroxyethoxy)pyrazolo[1,5-a]pyridine-3-carbonitrile.

Molecular Properties

Compound Name4-bromo-6-(2-hydroxyethoxy)pyrazolo[1,5-a]pyridine-3-carbonitrile
PubChem CID134434816
Molecular FormulaC10H8BrN3O2
Molecular Weight282.10 g/mol
Exact Mass280.98
IUPAC Name4-bromo-6-(2-hydroxyethoxy)pyrazolo[1,5-a]pyridine-3-carbonitrile
SMILESN#Cc1cnn2cc(OCCO)cc(Br)c12
InChIInChI=1S/C10H8BrN3O2/c11-9-3-8(16-2-1-15)6-14-10(9)7(4-12)5-13-14/h3,5-6,15H,1-2H2
InChIKeyIKVUIGSZDHIXBE-UHFFFAOYSA-N
XLogP1.34
TPSA70.55 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.10
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-bromo-6-(2-hydroxyethoxy)pyrazolo[1,5-a]pyridine-3-carbonitrile?
The IUPAC name of 4-bromo-6-(2-hydroxyethoxy)pyrazolo[1,5-a]pyridine-3-carbonitrile (CID 134434816) is 4-bromo-6-(2-hydroxyethoxy)pyrazolo[1,5-a]pyridine-3-carbonitrile.
What is the SMILES notation for 4-bromo-6-(2-hydroxyethoxy)pyrazolo[1,5-a]pyridine-3-carbonitrile?
The canonical SMILES for 4-bromo-6-(2-hydroxyethoxy)pyrazolo[1,5-a]pyridine-3-carbonitrile is N#Cc1cnn2cc(OCCO)cc(Br)c12.
What is the InChIKey of 4-bromo-6-(2-hydroxyethoxy)pyrazolo[1,5-a]pyridine-3-carbonitrile?
The InChIKey is IKVUIGSZDHIXBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8BrN3O2/c11-9-3-8(16-2-1-15)6-14-10(9)7(4-12)5-13-14/h3,5-6,15H,1-2H2.
What are the key properties of 4-bromo-6-(2-hydroxyethoxy)pyrazolo[1,5-a]pyridine-3-carbonitrile?
4-bromo-6-(2-hydroxyethoxy)pyrazolo[1,5-a]pyridine-3-carbonitrile has a molecular weight of 282.10 g/mol, XLogP of 1.34, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-6-(2-hydroxyethoxy)pyrazolo[1,5-a]pyridine-3-carbonitrile is sourced from PubChem (CID 134434816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).