7-bromo-1H-pyrazolo[5,4-c]pyridine

C6H4BrN3 — CID 70700903

IUPAC7-bromo-1H-pyrazolo[5,4-c]pyridine
SMILESBrc1nccc2cn[nH]c12
InChIInChI=1S/C6H4BrN3/c7-6-5-4(1-2-8-6)3-9-10-5/h1-3H,(H,9,10)
InChIKeyTZZAHSRLUFTAFW-UHFFFAOYSA-N
MW198.02 g/mol
LogP1.72
Rot. Bonds

About 7-bromo-1H-pyrazolo[5,4-c]pyridine

7-bromo-1H-pyrazolo[5,4-c]pyridine (PubChem CID 70700903) has the molecular formula C6H4BrN3 and a molecular weight of 198.02 g/mol. Its IUPAC name is 7-bromo-1H-pyrazolo[5,4-c]pyridine.

Molecular Properties

Compound Name7-bromo-1H-pyrazolo[5,4-c]pyridine
PubChem CID70700903
Molecular FormulaC6H4BrN3
Molecular Weight198.02 g/mol
Exact Mass196.96
IUPAC Name7-bromo-1H-pyrazolo[5,4-c]pyridine
SMILESBrc1nccc2cn[nH]c12
InChIInChI=1S/C6H4BrN3/c7-6-5-4(1-2-8-6)3-9-10-5/h1-3H,(H,9,10)
InChIKeyTZZAHSRLUFTAFW-UHFFFAOYSA-N
XLogP1.72
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.02
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-bromo-4-(1H-1,2,3-triazol-4-yl)pyridine
CID 60156093
3-Bromo-1H-pyrazolo(3,4-c)pyridine
CID 12668493
6-Bromo-1H-pyrazolo[4,3-b]pyridine
CID 40152259
5-chloro-1H-pyrazolo(3,4-c)pyridine
CID 640857
1H-Pyrazolo[3,4-c]pyridine
CID 6451441
4-(4-Bromo-1H-pyrazol-5-yl)pyridine
CID 45926067
5-(pyridin-3-yl)-1H-pyrazolo[3,4-c]pyridine
CID 86676680
3-methyl-5-(1-methyl-1H-pyrazol-4-yl)-1H-pyrazolo[3,4-c]pyridine
CID 71253739
3-Bromo-1H-pyrrolo[2,3-c]pyridine
CID 12410856
4-Bromo-1H-pyrrolo(2,3-c)pyridine
CID 12510055
1H-Pyrazolo[4,3-c]pyridine
CID 19930500
1H-Pyrazolo(4,3-b)pyridine
CID 21643653

Frequently Asked Questions

What is the IUPAC name of 7-bromo-1H-pyrazolo[5,4-c]pyridine?
The IUPAC name of 7-bromo-1H-pyrazolo[5,4-c]pyridine (CID 70700903) is 7-bromo-1H-pyrazolo[5,4-c]pyridine.
What is the SMILES notation for 7-bromo-1H-pyrazolo[5,4-c]pyridine?
The canonical SMILES for 7-bromo-1H-pyrazolo[5,4-c]pyridine is Brc1nccc2cn[nH]c12.
What is the InChIKey of 7-bromo-1H-pyrazolo[5,4-c]pyridine?
The InChIKey is TZZAHSRLUFTAFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4BrN3/c7-6-5-4(1-2-8-6)3-9-10-5/h1-3H,(H,9,10).
What are the key properties of 7-bromo-1H-pyrazolo[5,4-c]pyridine?
7-bromo-1H-pyrazolo[5,4-c]pyridine has a molecular weight of 198.02 g/mol, XLogP of 1.72, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-1H-pyrazolo[5,4-c]pyridine is sourced from PubChem (CID 70700903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).