5-propylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid

C10H11N3O2 — CID 63820617

IUPAC5-propylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid
SMILESCCCc1cc(C(=O)O)n2nccc2n1
InChIInChI=1S/C10H11N3O2/c1-2-3-7-6-8(10(14)15)13-9(12-7)4-5-11-13/h4-6H,2-3H2,1H3,(H,14,15)
InChIKeyNSGUFUYODNOSPH-UHFFFAOYSA-N
MW205.22 g/mol
LogP1.38
Rot. Bonds3

About 5-propylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid

5-propylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid (PubChem CID 63820617) has the molecular formula C10H11N3O2 and a molecular weight of 205.22 g/mol. Its IUPAC name is 5-propylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid.

Molecular Properties

Compound Name5-propylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid
PubChem CID63820617
Molecular FormulaC10H11N3O2
Molecular Weight205.22 g/mol
Exact Mass205.09
IUPAC Name5-propylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid
SMILESCCCc1cc(C(=O)O)n2nccc2n1
InChIInChI=1S/C10H11N3O2/c1-2-3-7-6-8(10(14)15)13-9(12-7)4-5-11-13/h4-6H,2-3H2,1H3,(H,14,15)
InChIKeyNSGUFUYODNOSPH-UHFFFAOYSA-N
XLogP1.38
TPSA67.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-propylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid?
The IUPAC name of 5-propylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid (CID 63820617) is 5-propylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid.
What is the SMILES notation for 5-propylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid?
The canonical SMILES for 5-propylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid is CCCc1cc(C(=O)O)n2nccc2n1.
What is the InChIKey of 5-propylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid?
The InChIKey is NSGUFUYODNOSPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O2/c1-2-3-7-6-8(10(14)15)13-9(12-7)4-5-11-13/h4-6H,2-3H2,1H3,(H,14,15).
What are the key properties of 5-propylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid?
5-propylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid has a molecular weight of 205.22 g/mol, XLogP of 1.38, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid is sourced from PubChem (CID 63820617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).