7-chloro-2,5-dimethylpyrazolo[1,5-a]pyrimidine

C8H8ClN3 — CID 18406987

IUPAC7-chloro-2,5-dimethylpyrazolo[1,5-a]pyrimidine
SMILESCc1cc(Cl)n2nc(C)cc2n1
InChIInChI=1S/C8H8ClN3/c1-5-3-7(9)12-8(10-5)4-6(2)11-12/h3-4H,1-2H3
InChIKeyQGROGNQUPBOMJQ-UHFFFAOYSA-N
MW181.63 g/mol
LogP2.00
Rot. Bonds

About 7-chloro-2,5-dimethylpyrazolo[1,5-a]pyrimidine

7-chloro-2,5-dimethylpyrazolo[1,5-a]pyrimidine (PubChem CID 18406987) has the molecular formula C8H8ClN3 and a molecular weight of 181.63 g/mol. Its IUPAC name is 7-chloro-2,5-dimethylpyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name7-chloro-2,5-dimethylpyrazolo[1,5-a]pyrimidine
PubChem CID18406987
Molecular FormulaC8H8ClN3
Molecular Weight181.63 g/mol
Exact Mass181.04
IUPAC Name7-chloro-2,5-dimethylpyrazolo[1,5-a]pyrimidine
SMILESCc1cc(Cl)n2nc(C)cc2n1
InChIInChI=1S/C8H8ClN3/c1-5-3-7(9)12-8(10-5)4-6(2)11-12/h3-4H,1-2H3
InChIKeyQGROGNQUPBOMJQ-UHFFFAOYSA-N
XLogP2.00
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.63
LogP ≤ 52.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 7-chloro-2,5-dimethylpyrazolo[1,5-a]pyrimidine 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

4-chloro-2-(3,5-dimethyl-1H-pyrazol-1-yl)-6-methylpyrimidine
CID 911195
7-Chloro-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidine
CID 520127
2,5,7-Trimethylpyrazolo[1,5-a]pyrimidine
CID 3611062
2-Chloro-5,7-dimethylpyrazolo [1,5-a]pyrimidine
CID 19380134
LA 2851
CID 68910
2,5-Dimethyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
CID 753093
7-Chloro-2,5-dimethyl-(1,2,4)triazolo(1,5-a)pyrimidine
CID 15575744
7-Chloro-5-methyl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine
CID 1500131
2,5-Dimethylpyrazolo[1,5-a]pyrimidin-7-amine
CID 2768096
Pyrazolo(1,5-a)-1,3,5-triazine-2,4-diamine, 7-methyl-, hydrochloride (1:?)
CID 3054719
7-Chloro-5-methylpyrazolo[1,5-a]pyrimidine
CID 10487287
7-Chloro-3,5-dimethylpyrazolo(1,5-a)pyrimidine
CID 10487659

Frequently Asked Questions

What is the IUPAC name of 7-chloro-2,5-dimethylpyrazolo[1,5-a]pyrimidine?
The IUPAC name of 7-chloro-2,5-dimethylpyrazolo[1,5-a]pyrimidine (CID 18406987) is 7-chloro-2,5-dimethylpyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 7-chloro-2,5-dimethylpyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 7-chloro-2,5-dimethylpyrazolo[1,5-a]pyrimidine is Cc1cc(Cl)n2nc(C)cc2n1.
What is the InChIKey of 7-chloro-2,5-dimethylpyrazolo[1,5-a]pyrimidine?
The InChIKey is QGROGNQUPBOMJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8ClN3/c1-5-3-7(9)12-8(10-5)4-6(2)11-12/h3-4H,1-2H3.
What are the key properties of 7-chloro-2,5-dimethylpyrazolo[1,5-a]pyrimidine?
7-chloro-2,5-dimethylpyrazolo[1,5-a]pyrimidine has a molecular weight of 181.63 g/mol, XLogP of 2.00, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-2,5-dimethylpyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 18406987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).