3-bromo-1-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine

C8H12BrN3 — CID 105487454

IUPAC3-bromo-1-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine
SMILESCCn1nc(Br)c2c1CCNC2
InChIInChI=1S/C8H12BrN3/c1-2-12-7-3-4-10-5-6(7)8(9)11-12/h10H,2-5H2,1H3
InChIKeyARNFFGJIRNJBTH-UHFFFAOYSA-N
MW230.11 g/mol
LogP1.31
Rot. Bonds1

About 3-bromo-1-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine

3-bromo-1-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine (PubChem CID 105487454) has the molecular formula C8H12BrN3 and a molecular weight of 230.11 g/mol. Its IUPAC name is 3-bromo-1-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine.

Molecular Properties

Compound Name3-bromo-1-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine
PubChem CID105487454
Molecular FormulaC8H12BrN3
Molecular Weight230.11 g/mol
Exact Mass229.02
IUPAC Name3-bromo-1-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine
SMILESCCn1nc(Br)c2c1CCNC2
InChIInChI=1S/C8H12BrN3/c1-2-12-7-3-4-10-5-6(7)8(9)11-12/h10H,2-5H2,1H3
InChIKeyARNFFGJIRNJBTH-UHFFFAOYSA-N
XLogP1.31
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.11
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-bromo-1-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine 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

1,3-diethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine
CID 84647059
methyl 1-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxylate
CID 105462928
1-ethyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine-3-carboxylic acid
CID 105448942
(2-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl)methanamine
CID 105439071
2-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxylic acid
CID 105448944
(2-ethyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-3-yl)methanol
CID 105439524
1-(4-bromophenyl)-3-methyl-4,5,6,7-tetrahydropyrazolo[4,5-c]pyridine
CID 82586524
1-(2-methylpropyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carbonitrile
CID 105456666
3-ethyl-1-propan-2-yl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine
CID 82586537
1-(2-methylpropyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxylic acid
CID 105480647
1-ethyl-3-methyl-4,5,6,7-tetrahydroindazole
CID 121292185
1-[(4-bromophenyl)methyl]-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carbonitrile
CID 82588668

Frequently Asked Questions

What is the IUPAC name of 3-bromo-1-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine?
The IUPAC name of 3-bromo-1-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine (CID 105487454) is 3-bromo-1-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine.
What is the SMILES notation for 3-bromo-1-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine?
The canonical SMILES for 3-bromo-1-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine is CCn1nc(Br)c2c1CCNC2.
What is the InChIKey of 3-bromo-1-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine?
The InChIKey is ARNFFGJIRNJBTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12BrN3/c1-2-12-7-3-4-10-5-6(7)8(9)11-12/h10H,2-5H2,1H3.
What are the key properties of 3-bromo-1-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine?
3-bromo-1-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine has a molecular weight of 230.11 g/mol, XLogP of 1.31, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-1-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine is sourced from PubChem (CID 105487454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).