5-chloro-2,7-dimethylpyrazolo[3,4-c]pyridine

C8H8ClN3 — CID 162432890

IUPAC5-chloro-2,7-dimethylpyrazolo[3,4-c]pyridine
SMILESCc1nc(Cl)cc2cn(C)nc12
InChIInChI=1S/C8H8ClN3/c1-5-8-6(3-7(9)10-5)4-12(2)11-8/h3-4H,1-2H3
InChIKeyAOMZRAICXNFYJE-UHFFFAOYSA-N
MW181.63 g/mol
LogP1.93
Rot. Bonds

About 5-chloro-2,7-dimethylpyrazolo[3,4-c]pyridine

5-chloro-2,7-dimethylpyrazolo[3,4-c]pyridine (PubChem CID 162432890) has the molecular formula C8H8ClN3 and a molecular weight of 181.63 g/mol. Its IUPAC name is 5-chloro-2,7-dimethylpyrazolo[3,4-c]pyridine.

Molecular Properties

Compound Name5-chloro-2,7-dimethylpyrazolo[3,4-c]pyridine
PubChem CID162432890
Molecular FormulaC8H8ClN3
Molecular Weight181.63 g/mol
Exact Mass181.04
IUPAC Name5-chloro-2,7-dimethylpyrazolo[3,4-c]pyridine
SMILESCc1nc(Cl)cc2cn(C)nc12
InChIInChI=1S/C8H8ClN3/c1-5-8-6(3-7(9)10-5)4-12(2)11-8/h3-4H,1-2H3
InChIKeyAOMZRAICXNFYJE-UHFFFAOYSA-N
XLogP1.93
TPSA30.71 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 ≤ 51.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

ethane;2,5,7-trimethylindazole
CID 156845071
4-chloro-2-(1,3-dimethylpyrazol-4-yl)-6-methylpyrimidine
CID 83090000
ethane;2,5,7-trimethylindazol-6-ol
CID 162433004
2-chloro-6-(2,7-dimethylindazol-5-yl)-8-fluoroquinoline
CID 142492191
7-chloro-6-fluoro-2,4-dimethylindazole
CID 166076486
ethane;N,2,5-trimethylindazol-7-amine
CID 176566989
6-chloro-2,5-dimethylindazole
CID 171662405
2,7-dimethylpyrazolo[3,4-c]pyridin-5-amine;ethane;1,3,6-trimethylpyrrolo[1,2-a]pyrazine
CID 176567044
7-fluoro-2,6-dimethylindazol-5-amine;hydrochloride
CID 168914385
6-chloro-N-[(1,3-dimethylpyrazol-4-yl)methyl]-2-methylpyrimidin-4-amine
CID 112671792
ethyl 5-chloro-2-methylpyrazolo[4,3-b]pyridine-7-carboxylate
CID 169206457
6-chloro-7-fluoro-2-methylindazole
CID 171662432

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2,7-dimethylpyrazolo[3,4-c]pyridine?
The IUPAC name of 5-chloro-2,7-dimethylpyrazolo[3,4-c]pyridine (CID 162432890) is 5-chloro-2,7-dimethylpyrazolo[3,4-c]pyridine.
What is the SMILES notation for 5-chloro-2,7-dimethylpyrazolo[3,4-c]pyridine?
The canonical SMILES for 5-chloro-2,7-dimethylpyrazolo[3,4-c]pyridine is Cc1nc(Cl)cc2cn(C)nc12.
What is the InChIKey of 5-chloro-2,7-dimethylpyrazolo[3,4-c]pyridine?
The InChIKey is AOMZRAICXNFYJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8ClN3/c1-5-8-6(3-7(9)10-5)4-12(2)11-8/h3-4H,1-2H3.
What are the key properties of 5-chloro-2,7-dimethylpyrazolo[3,4-c]pyridine?
5-chloro-2,7-dimethylpyrazolo[3,4-c]pyridine has a molecular weight of 181.63 g/mol, XLogP of 1.93, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2,7-dimethylpyrazolo[3,4-c]pyridine is sourced from PubChem (CID 162432890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).