7-(furan-2-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid

C11H7N3O3 — CID 6485369

IUPAC7-(furan-2-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid
SMILESO=C(O)c1cc2nccc(-c3ccco3)n2n1
InChIInChI=1S/C11H7N3O3/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)
InChIKeyWVANFBWIAZCONH-UHFFFAOYSA-N
MW229.20 g/mol
LogP1.69
Rot. Bonds2

About 7-(furan-2-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid

7-(furan-2-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid (PubChem CID 6485369) has the molecular formula C11H7N3O3 and a molecular weight of 229.20 g/mol. Its IUPAC name is 7-(furan-2-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid.

Molecular Properties

Compound Name7-(furan-2-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid
PubChem CID6485369
Molecular FormulaC11H7N3O3
Molecular Weight229.20 g/mol
Exact Mass229.05
IUPAC Name7-(furan-2-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid
SMILESO=C(O)c1cc2nccc(-c3ccco3)n2n1
InChIInChI=1S/C11H7N3O3/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)
InChIKeyWVANFBWIAZCONH-UHFFFAOYSA-N
XLogP1.69
TPSA80.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.20
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-(furan-2-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid?
The IUPAC name of 7-(furan-2-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid (CID 6485369) is 7-(furan-2-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid.
What is the SMILES notation for 7-(furan-2-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid?
The canonical SMILES for 7-(furan-2-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid is O=C(O)c1cc2nccc(-c3ccco3)n2n1.
What is the InChIKey of 7-(furan-2-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid?
The InChIKey is WVANFBWIAZCONH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7N3O3/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-(furan-2-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid?
7-(furan-2-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid has a molecular weight of 229.20 g/mol, XLogP of 1.69, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(furan-2-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid is sourced from PubChem (CID 6485369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).