3-amino-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxylic acid

C8H8N4O2 — CID 83818121

IUPAC3-amino-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxylic acid
SMILESCc1nn2cc(C(=O)O)cnc2c1N
InChIInChI=1S/C8H8N4O2/c1-4-6(9)7-10-2-5(8(13)14)3-12(7)11-4/h2-3H,9H2,1H3,(H,13,14)
InChIKeyFBTPLLIKSKCBKU-UHFFFAOYSA-N
MW192.18 g/mol
LogP0.32
Rot. Bonds1

About 3-amino-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxylic acid

3-amino-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxylic acid (PubChem CID 83818121) has the molecular formula C8H8N4O2 and a molecular weight of 192.18 g/mol. Its IUPAC name is 3-amino-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxylic acid.

Molecular Properties

Compound Name3-amino-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxylic acid
PubChem CID83818121
Molecular FormulaC8H8N4O2
Molecular Weight192.18 g/mol
Exact Mass192.06
IUPAC Name3-amino-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxylic acid
SMILESCc1nn2cc(C(=O)O)cnc2c1N
InChIInChI=1S/C8H8N4O2/c1-4-6(9)7-10-2-5(8(13)14)3-12(7)11-4/h2-3H,9H2,1H3,(H,13,14)
InChIKeyFBTPLLIKSKCBKU-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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Frequently Asked Questions

What is the IUPAC name of 3-amino-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxylic acid?
The IUPAC name of 3-amino-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxylic acid (CID 83818121) is 3-amino-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxylic acid.
What is the SMILES notation for 3-amino-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxylic acid?
The canonical SMILES for 3-amino-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxylic acid is Cc1nn2cc(C(=O)O)cnc2c1N.
What is the InChIKey of 3-amino-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxylic acid?
The InChIKey is FBTPLLIKSKCBKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N4O2/c1-4-6(9)7-10-2-5(8(13)14)3-12(7)11-4/h2-3H,9H2,1H3,(H,13,14).
What are the key properties of 3-amino-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxylic acid?
3-amino-2-methylpyrazolo[1,5-a]pyrimidine-6-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-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxylic acid is sourced from PubChem (CID 83818121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).