6-methyl-5H-imidazo[1,2-b]pyrazole-7-carboxylic acid

C7H7N3O2 — CID 82414740

IUPAC6-methyl-5H-imidazo[1,2-b]pyrazole-7-carboxylic acid
SMILESCc1[nH]n2ccnc2c1C(=O)O
InChIInChI=1S/C7H7N3O2/c1-4-5(7(11)12)6-8-2-3-10(6)9-4/h2-3,9H,1H3,(H,11,12)
InChIKeyLLYKXJRKILYDRF-UHFFFAOYSA-N
MW165.15 g/mol
LogP0.67
Rot. Bonds1

About 6-methyl-5H-imidazo[1,2-b]pyrazole-7-carboxylic acid

6-methyl-5H-imidazo[1,2-b]pyrazole-7-carboxylic acid (PubChem CID 82414740) has the molecular formula C7H7N3O2 and a molecular weight of 165.15 g/mol. Its IUPAC name is 6-methyl-5H-imidazo[1,2-b]pyrazole-7-carboxylic acid.

Molecular Properties

Compound Name6-methyl-5H-imidazo[1,2-b]pyrazole-7-carboxylic acid
PubChem CID82414740
Molecular FormulaC7H7N3O2
Molecular Weight165.15 g/mol
Exact Mass165.05
IUPAC Name6-methyl-5H-imidazo[1,2-b]pyrazole-7-carboxylic acid
SMILESCc1[nH]n2ccnc2c1C(=O)O
InChIInChI=1S/C7H7N3O2/c1-4-5(7(11)12)6-8-2-3-10(6)9-4/h2-3,9H,1H3,(H,11,12)
InChIKeyLLYKXJRKILYDRF-UHFFFAOYSA-N
XLogP0.67
TPSA70.39 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.15
LogP ≤ 50.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-5H-imidazo[1,2-b]pyrazole-7-carboxylic acid?
The IUPAC name of 6-methyl-5H-imidazo[1,2-b]pyrazole-7-carboxylic acid (CID 82414740) is 6-methyl-5H-imidazo[1,2-b]pyrazole-7-carboxylic acid.
What is the SMILES notation for 6-methyl-5H-imidazo[1,2-b]pyrazole-7-carboxylic acid?
The canonical SMILES for 6-methyl-5H-imidazo[1,2-b]pyrazole-7-carboxylic acid is Cc1[nH]n2ccnc2c1C(=O)O.
What is the InChIKey of 6-methyl-5H-imidazo[1,2-b]pyrazole-7-carboxylic acid?
The InChIKey is LLYKXJRKILYDRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3O2/c1-4-5(7(11)12)6-8-2-3-10(6)9-4/h2-3,9H,1H3,(H,11,12).
What are the key properties of 6-methyl-5H-imidazo[1,2-b]pyrazole-7-carboxylic acid?
6-methyl-5H-imidazo[1,2-b]pyrazole-7-carboxylic acid has a molecular weight of 165.15 g/mol, XLogP of 0.67, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-5H-imidazo[1,2-b]pyrazole-7-carboxylic acid is sourced from PubChem (CID 82414740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).