3-chloropyrazolo[1,5-a]pyrimidine-2-carboxylic acid

C7H4ClN3O2 — CID 3160253

IUPAC3-chloropyrazolo[1,5-a]pyrimidine-2-carboxylic acid
SMILESO=C(O)c1nn2cccnc2c1Cl
InChIInChI=1S/C7H4ClN3O2/c8-4-5(7(12)13)10-11-3-1-2-9-6(4)11/h1-3H,(H,12,13)
InChIKeyRIWROFKWJCRDJY-UHFFFAOYSA-N
MW197.58 g/mol
LogP1.08
Rot. Bonds1

About 3-chloropyrazolo[1,5-a]pyrimidine-2-carboxylic acid

3-chloropyrazolo[1,5-a]pyrimidine-2-carboxylic acid (PubChem CID 3160253) has the molecular formula C7H4ClN3O2 and a molecular weight of 197.58 g/mol. Its IUPAC name is 3-chloropyrazolo[1,5-a]pyrimidine-2-carboxylic acid.

Molecular Properties

Compound Name3-chloropyrazolo[1,5-a]pyrimidine-2-carboxylic acid
PubChem CID3160253
Molecular FormulaC7H4ClN3O2
Molecular Weight197.58 g/mol
Exact Mass197.00
IUPAC Name3-chloropyrazolo[1,5-a]pyrimidine-2-carboxylic acid
SMILESO=C(O)c1nn2cccnc2c1Cl
InChIInChI=1S/C7H4ClN3O2/c8-4-5(7(12)13)10-11-3-1-2-9-6(4)11/h1-3H,(H,12,13)
InChIKeyRIWROFKWJCRDJY-UHFFFAOYSA-N
XLogP1.08
TPSA67.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.58
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-chloropyrazolo[1,5-a]pyrimidine-2-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

Pyrazolo[1,5-a]pyrimidine-2-carboxylic acid
CID 670824
Pyrazolo(1,5-a)pyrimidine-2-carboxylic acid, 3-chloro-5-methyl-7-(trifluoromethyl)-
CID 1153121
6-Bromopyrazolo[1,5-a]pyrimidine-2-carboxylic acid
CID 771938
3-Chloro-6-(2-hydroxyethyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid
CID 1096895
6-(2-Hydroxyethyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid
CID 1259795
5-Methylpyrazolo(1,5-a)pyrimidine-7-carboxylic acid
CID 29091059
7-(Trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid
CID 7017531
3-Bromopyrazolo(1,5-a)pyrimidine-2-carboxylic acid
CID 17024812
6-Methylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid
CID 18524444
(1,2,4)Triazolo(1,5-a)pyrimidine-7-carboxylic acid
CID 25323807
Pyrazolo(1,5-a)pyrimidine-5-carboxylic acid
CID 28875802
Ethyl 6-chloropyrazolo[1,5-A]pyrimidine-2-carboxylate
CID 49761469

Frequently Asked Questions

What is the IUPAC name of 3-chloropyrazolo[1,5-a]pyrimidine-2-carboxylic acid?
The IUPAC name of 3-chloropyrazolo[1,5-a]pyrimidine-2-carboxylic acid (CID 3160253) is 3-chloropyrazolo[1,5-a]pyrimidine-2-carboxylic acid.
What is the SMILES notation for 3-chloropyrazolo[1,5-a]pyrimidine-2-carboxylic acid?
The canonical SMILES for 3-chloropyrazolo[1,5-a]pyrimidine-2-carboxylic acid is O=C(O)c1nn2cccnc2c1Cl.
What is the InChIKey of 3-chloropyrazolo[1,5-a]pyrimidine-2-carboxylic acid?
The InChIKey is RIWROFKWJCRDJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4ClN3O2/c8-4-5(7(12)13)10-11-3-1-2-9-6(4)11/h1-3H,(H,12,13).
What are the key properties of 3-chloropyrazolo[1,5-a]pyrimidine-2-carboxylic acid?
3-chloropyrazolo[1,5-a]pyrimidine-2-carboxylic acid has a molecular weight of 197.58 g/mol, XLogP of 1.08, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloropyrazolo[1,5-a]pyrimidine-2-carboxylic acid is sourced from PubChem (CID 3160253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).