3-amino-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid

C8H8N4O2 — CID 84719834

IUPAC3-amino-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid
SMILESCc1cc(C(=O)O)n2ncc(N)c2n1
InChIInChI=1S/C8H8N4O2/c1-4-2-6(8(13)14)12-7(11-4)5(9)3-10-12/h2-3H,9H2,1H3,(H,13,14)
InChIKeyWKVBWJNNOUPABL-UHFFFAOYSA-N
MW192.18 g/mol
LogP0.32
Rot. Bonds1

About 3-amino-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid

3-amino-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid (PubChem CID 84719834) has the molecular formula C8H8N4O2 and a molecular weight of 192.18 g/mol. Its IUPAC name is 3-amino-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid.

Molecular Properties

Compound Name3-amino-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid
PubChem CID84719834
Molecular FormulaC8H8N4O2
Molecular Weight192.18 g/mol
Exact Mass192.06
IUPAC Name3-amino-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid
SMILESCc1cc(C(=O)O)n2ncc(N)c2n1
InChIInChI=1S/C8H8N4O2/c1-4-2-6(8(13)14)12-7(11-4)5(9)3-10-12/h2-3H,9H2,1H3,(H,13,14)
InChIKeyWKVBWJNNOUPABL-UHFFFAOYSA-N
XLogP0.32
TPSA93.51 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.18
LogP ≤ 50.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-methylpyrazolo[1,5-a]pyrimidine-3,7-dicarboxylic acid
CID 90791486
5-methyl-3-(4-methyl-1,3-dioxetan-2-yl)pyrazolo[1,5-a]pyrimidine-7-carboxylic acid
CID 70296924
methyl 3-amino-5-(1-hydroxyethenyl)pyrazolo[1,5-a]pyrimidine-7-carboxylate
CID 70317954
2-amino-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxylic acid
CID 84719956
5-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxylic acid
CID 25247790
3-methyl-5-phenylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid
CID 113433503
5-tert-butyl-3-methylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid
CID 104708911
5-cyclopropyl-3-methylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid
CID 97182124
methyl 3-fluoro-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxylate;methyl 5-methylpyrazolo[1,5-a]pyrimidine-7-carboxylate
CID 160635776
3-ethyl-5-pyridin-4-ylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid
CID 104617872
1,6-dimethylpyrazolo[3,4-b]pyridine-4-carboxylic acid
CID 19616512
3-carbamoyl-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid;N-(2-chloro-4-fluorophenyl)cyclohexanecarboxamide
CID 145182203

Frequently Asked Questions

What is the IUPAC name of 3-amino-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid?
The IUPAC name of 3-amino-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid (CID 84719834) is 3-amino-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid.
What is the SMILES notation for 3-amino-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid?
The canonical SMILES for 3-amino-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid is Cc1cc(C(=O)O)n2ncc(N)c2n1.
What is the InChIKey of 3-amino-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid?
The InChIKey is WKVBWJNNOUPABL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N4O2/c1-4-2-6(8(13)14)12-7(11-4)5(9)3-10-12/h2-3H,9H2,1H3,(H,13,14).
What are the key properties of 3-amino-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid?
3-amino-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid has a molecular weight of 192.18 g/mol, XLogP of 0.32, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid is sourced from PubChem (CID 84719834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).