3-bromopyrazolo[1,5-a]pyridine-5-carboxylic acid;ethane

C10H11BrN2O2 — CID 144630310

IUPAC3-bromopyrazolo[1,5-a]pyridine-5-carboxylic acid;ethane
SMILESCC.O=C(O)c1ccn2ncc(Br)c2c1
InChIInChI=1S/C8H5BrN2O2.C2H6/c9-6-4-10-11-2-1-5(8(12)13)3-7(6)11;1-2/h1-4H,(H,12,13);1-2H3
InChIKeyTXPRSDKJSZYBTK-UHFFFAOYSA-N
MW271.11 g/mol
LogP2.82
Rot. Bonds1

About 3-bromopyrazolo[1,5-a]pyridine-5-carboxylic acid;ethane

3-bromopyrazolo[1,5-a]pyridine-5-carboxylic acid;ethane (PubChem CID 144630310) has the molecular formula C10H11BrN2O2 and a molecular weight of 271.11 g/mol. Its IUPAC name is 3-bromopyrazolo[1,5-a]pyridine-5-carboxylic acid;ethane.

Molecular Properties

Compound Name3-bromopyrazolo[1,5-a]pyridine-5-carboxylic acid;ethane
PubChem CID144630310
Molecular FormulaC10H11BrN2O2
Molecular Weight271.11 g/mol
Exact Mass270.00
IUPAC Name3-bromopyrazolo[1,5-a]pyridine-5-carboxylic acid;ethane
SMILESCC.O=C(O)c1ccn2ncc(Br)c2c1
InChIInChI=1S/C8H5BrN2O2.C2H6/c9-6-4-10-11-2-1-5(8(12)13)3-7(6)11;1-2/h1-4H,(H,12,13);1-2H3
InChIKeyTXPRSDKJSZYBTK-UHFFFAOYSA-N
XLogP2.82
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.11
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-phenyl-3-(pyridin-4-yl)-1H-pyrazole-4-carboxylic acid
CID 976454
Pyrazolo(1,5-a)pyridine-3-carboxylic acid
CID 2795462
6-[(6-Bromo-2-phenylpyrazolo[1,5-a]pyridin-3-yl)methyl]pyridine-2-carboxylic acid
CID 60151285
1-phenyl-5-pyridin-4-yl-1H-pyrazole-4-carboxylic acid
CID 20855127
2-Phenylpyrazolo(1,5-a)pyridine-3-carboxylic acid
CID 12872295
5-(Methoxycarbonyl)pyrazolo[1,5-a]pyridine-3-carboxylic acid
CID 123725403
Pyrazolo(1,5-a)pyridine-2-carboxylic acid
CID 7127820
2-(1-Methylpyrazol-3-yl)pyridine-4-carboxylic acid
CID 105455028
3-Bromo-2-(1-hydroxycyclohexyl)-[1,2]selenazolo[2,3-a]pyridin-8-ium-5-carboxylic acid chloride
CID 169245718
4-(1-(2-bromo-6-fluorobenzyl)-1H-pyrazolo[4,3-b]pyridin-3-yl)-3-fluoro benzoic acid
CID 73296939
4-[1-[(2-Bromo-3-fluorophenyl)methyl]pyrazolo[4,3-b]pyridin-3-yl]-3-fluorobenzoic acid
CID 73297114
Pyrazolo[1,5-a]pyridine-5-carboxylic acid
CID 10997360

Frequently Asked Questions

What is the IUPAC name of 3-bromopyrazolo[1,5-a]pyridine-5-carboxylic acid;ethane?
The IUPAC name of 3-bromopyrazolo[1,5-a]pyridine-5-carboxylic acid;ethane (CID 144630310) is 3-bromopyrazolo[1,5-a]pyridine-5-carboxylic acid;ethane.
What is the SMILES notation for 3-bromopyrazolo[1,5-a]pyridine-5-carboxylic acid;ethane?
The canonical SMILES for 3-bromopyrazolo[1,5-a]pyridine-5-carboxylic acid;ethane is CC.O=C(O)c1ccn2ncc(Br)c2c1.
What is the InChIKey of 3-bromopyrazolo[1,5-a]pyridine-5-carboxylic acid;ethane?
The InChIKey is TXPRSDKJSZYBTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5BrN2O2.C2H6/c9-6-4-10-11-2-1-5(8(12)13)3-7(6)11;1-2/h1-4H,(H,12,13);1-2H3.
What are the key properties of 3-bromopyrazolo[1,5-a]pyridine-5-carboxylic acid;ethane?
3-bromopyrazolo[1,5-a]pyridine-5-carboxylic acid;ethane has a molecular weight of 271.11 g/mol, XLogP of 2.82, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromopyrazolo[1,5-a]pyridine-5-carboxylic acid;ethane is sourced from PubChem (CID 144630310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).