chempirical

2-Methylpyrazolo[1,5-A]pyrimidine-6-carboxylic acid

C8H7N3O2CAS 739364-95-5177.16 g/mol

Open in Covalent MOL file
NOOHNN
Carboxylic acid

Properties

Molecular formula
C8H7N3O2
Molar mass
177.16 g/mol
Exact mass
177.0538 Da
logP
0.74Crippen estimate
Polar surface area
67.5 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
1

Identifiers

CAS number
739364-95-5
SMILES
Cc1cc2ncc(C(=O)O)cn2n1
InChIKey
YHVGUXFUOSJCFJ-UHFFFAOYSA-N
InChI
InChI=1S/C8H7N3O2/c1-5-2-7-9-3-6(8(12)13)4-11(7)10-5/h2-4H,1H3,(H,12,13)

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Names and synonyms

1 names
  • Pyrazolo[1,5-a]pyrimidine-6-carboxylic acid, 2-methyl-

Work with 2-Methylpyrazolo[1,5-A]pyrimidine-6-carboxylic acid

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

5-Methyl-2-pyrazinecarboxylic acid5521-55-141 % similar 5-Methylnicotinic acid3222-49-940 % similar [2,2′-Bipyridine]-5,5′-dicarboxylic acid1802-30-840 % similar Dinicotinic acid499-81-039 % similar 5,6-Dichloronicotinic acid41667-95-239 % similar 3,5-Dimethylbenzoic acid499-06-938 % similar Uvitic acid499-49-038 % similar 3-Bromoimidazo[1,2-A]pyridine-6-carboxylic acid886362-00-138 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Methyl 1,2,3-benzotriazole-5-carboxylate113053-50-2 4-Phenyl-1,2,4-triazolidine-3,5-dione15988-11-1 Luminol521-31-3 1-Methyl-5-nitroindazole5228-49-9 3-Methyl-6-nitro-1H-indazole6494-19-5

Elsewhere

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