6-(2-hydroxyethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid

C9H9N3O3 — CID 3161120

IUPAC6-(2-hydroxyethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid
SMILESO=C(O)c1cnn2cc(CCO)cnc12
InChIInChI=1S/C9H9N3O3/c13-2-1-6-3-10-8-7(9(14)15)4-11-12(8)5-6/h3-5,13H,1-2H2,(H,14,15)
InChIKeyZHSNJCKEJWLPRA-UHFFFAOYSA-N
MW207.19 g/mol
LogP-0.04
Rot. Bonds3

About 6-(2-hydroxyethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid

6-(2-hydroxyethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid (PubChem CID 3161120) has the molecular formula C9H9N3O3 and a molecular weight of 207.19 g/mol. Its IUPAC name is 6-(2-hydroxyethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid.

Molecular Properties

Compound Name6-(2-hydroxyethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid
PubChem CID3161120
Molecular FormulaC9H9N3O3
Molecular Weight207.19 g/mol
Exact Mass207.06
IUPAC Name6-(2-hydroxyethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid
SMILESO=C(O)c1cnn2cc(CCO)cnc12
InChIInChI=1S/C9H9N3O3/c13-2-1-6-3-10-8-7(9(14)15)4-11-12(8)5-6/h3-5,13H,1-2H2,(H,14,15)
InChIKeyZHSNJCKEJWLPRA-UHFFFAOYSA-N
XLogP-0.04
TPSA87.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.19
LogP ≤ 5-0.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(2-hydroxyethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid?
The IUPAC name of 6-(2-hydroxyethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid (CID 3161120) is 6-(2-hydroxyethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid.
What is the SMILES notation for 6-(2-hydroxyethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid?
The canonical SMILES for 6-(2-hydroxyethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid is O=C(O)c1cnn2cc(CCO)cnc12.
What is the InChIKey of 6-(2-hydroxyethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid?
The InChIKey is ZHSNJCKEJWLPRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O3/c13-2-1-6-3-10-8-7(9(14)15)4-11-12(8)5-6/h3-5,13H,1-2H2,(H,14,15).
What are the key properties of 6-(2-hydroxyethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid?
6-(2-hydroxyethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid has a molecular weight of 207.19 g/mol, XLogP of -0.04, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-hydroxyethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid is sourced from PubChem (CID 3161120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).