7-chloro-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-5-carboxylic acid

C8H3ClF3N3O2 — CID 82271527

IUPAC7-chloro-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-5-carboxylic acid
SMILESO=C(O)c1cc(Cl)n2nc(C(F)(F)F)cc2n1
InChIInChI=1S/C8H3ClF3N3O2/c9-5-1-3(7(16)17)13-6-2-4(8(10,11)12)14-15(5)6/h1-2H,(H,16,17)
InChIKeyBELQSKDHEBELGN-UHFFFAOYSA-N
MW265.58 g/mol
LogP2.10
Rot. Bonds1

About 7-chloro-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-5-carboxylic acid

7-chloro-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-5-carboxylic acid (PubChem CID 82271527) has the molecular formula C8H3ClF3N3O2 and a molecular weight of 265.58 g/mol. Its IUPAC name is 7-chloro-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-5-carboxylic acid.

Molecular Properties

Compound Name7-chloro-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-5-carboxylic acid
PubChem CID82271527
Molecular FormulaC8H3ClF3N3O2
Molecular Weight265.58 g/mol
Exact Mass264.99
IUPAC Name7-chloro-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-5-carboxylic acid
SMILESO=C(O)c1cc(Cl)n2nc(C(F)(F)F)cc2n1
InChIInChI=1S/C8H3ClF3N3O2/c9-5-1-3(7(16)17)13-6-2-4(8(10,11)12)14-15(5)6/h1-2H,(H,16,17)
InChIKeyBELQSKDHEBELGN-UHFFFAOYSA-N
XLogP2.10
TPSA67.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.58
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 7-chloro-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-5-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-tert-butyl-7-chloropyrazolo[1,5-a]pyrimidine-5-carboxylic acid
CID 82271525
7-chloro-2-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-5-carboxylic acid
CID 82271539
7-chloro-2-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxylic acid
CID 84679300
6-(trifluoromethyl)pyridine-2,4-dicarboxylic acid
CID 130114973
2-tert-butyl-7-chloro-[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxylic acid
CID 115054997
6-(trifluoromethyl)imidazo[1,2-a]pyrazine-2-carboxylic acid
CID 67517195
5-chloro-4-(difluoromethyl)-6-(trifluoromethyl)pyridine-2-carboxylic acid
CID 134675155
2-amino-6-(trifluoromethyl)imidazo[1,2-b]pyridazine-3-carboxylic acid
CID 118115899
4-chloro-3-(difluoromethyl)-6-(trifluoromethyl)pyridine-2-carboxylic acid
CID 134674290
5-methyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 146680380
2-cyclopropyl-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxylic acid
CID 82078907
2,7-dicyclopropylpyrazolo[1,5-a]pyrimidine-5-carboxylic acid
CID 71683769

Frequently Asked Questions

What is the IUPAC name of 7-chloro-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-5-carboxylic acid?
The IUPAC name of 7-chloro-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-5-carboxylic acid (CID 82271527) is 7-chloro-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-5-carboxylic acid.
What is the SMILES notation for 7-chloro-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-5-carboxylic acid?
The canonical SMILES for 7-chloro-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-5-carboxylic acid is O=C(O)c1cc(Cl)n2nc(C(F)(F)F)cc2n1.
What is the InChIKey of 7-chloro-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-5-carboxylic acid?
The InChIKey is BELQSKDHEBELGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H3ClF3N3O2/c9-5-1-3(7(16)17)13-6-2-4(8(10,11)12)14-15(5)6/h1-2H,(H,16,17).
What are the key properties of 7-chloro-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-5-carboxylic acid?
7-chloro-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-5-carboxylic acid has a molecular weight of 265.58 g/mol, XLogP of 2.10, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-5-carboxylic acid is sourced from PubChem (CID 82271527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).