7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid

C11H7N3O2S — CID 6485368

IUPAC7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid
SMILESO=C(O)c1cc2nccc(-c3cccs3)n2n1
InChIInChI=1S/C11H7N3O2S/c15-11(16)7-6-10-12-4-3-8(14(10)13-7)9-2-1-5-17-9/h1-6H,(H,15,16)
InChIKeyLRZOJAAEMGPNBK-UHFFFAOYSA-N
MW245.26 g/mol
LogP2.16
Rot. Bonds2

About 7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid

7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid (PubChem CID 6485368) has the molecular formula C11H7N3O2S and a molecular weight of 245.26 g/mol. Its IUPAC name is 7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid.

Molecular Properties

Compound Name7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid
PubChem CID6485368
Molecular FormulaC11H7N3O2S
Molecular Weight245.26 g/mol
Exact Mass245.03
IUPAC Name7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid
SMILESO=C(O)c1cc2nccc(-c3cccs3)n2n1
InChIInChI=1S/C11H7N3O2S/c15-11(16)7-6-10-12-4-3-8(14(10)13-7)9-2-1-5-17-9/h1-6H,(H,15,16)
InChIKeyLRZOJAAEMGPNBK-UHFFFAOYSA-N
XLogP2.16
TPSA67.49 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.26
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-Chloro-5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid
CID 749120
5-(Thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid
CID 755339
Methyl 5-(2-thienyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxylate
CID 742282
1-(Pyridin-4-ylmethyl)-6-thiophen-2-ylpyrazolo[5,4-b]pyridine-4-carboxylic acid
CID 71600808
6-(3-Methylthiophen-2-yl)-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxylic acid
CID 71600809
6-(4-Methylthiophen-2-yl)-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxylic acid
CID 71600810
6-(5-Methylthiophen-2-yl)-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxylic acid
CID 71600936
7-Thiophen-2-ylpyrazolo[1,5-a]pyrimidine-5-carboxylic acid
CID 49830805
5-(2-Thienyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid
CID 759110
3-Bromo-5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid
CID 1101974
1,3-dimethyl-6-(thiophen-2-yl)-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
CID 16227716
7-(Thiophen-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid
CID 4773601

Frequently Asked Questions

What is the IUPAC name of 7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid?
The IUPAC name of 7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid (CID 6485368) is 7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid.
What is the SMILES notation for 7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid?
The canonical SMILES for 7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid is O=C(O)c1cc2nccc(-c3cccs3)n2n1.
What is the InChIKey of 7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid?
The InChIKey is LRZOJAAEMGPNBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7N3O2S/c15-11(16)7-6-10-12-4-3-8(14(10)13-7)9-2-1-5-17-9/h1-6H,(H,15,16).
What are the key properties of 7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid?
7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid has a molecular weight of 245.26 g/mol, XLogP of 2.16, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid is sourced from PubChem (CID 6485368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).