2-[(5-bromo-6-fluoroquinolin-2-yl)amino]ethanol

C11H10BrFN2O — CID 58228014

IUPAC2-[(5-bromo-6-fluoroquinolin-2-yl)amino]ethanol
SMILESOCCNc1ccc2c(Br)c(F)ccc2n1
InChIInChI=1S/C11H10BrFN2O/c12-11-7-1-4-10(14-5-6-16)15-9(7)3-2-8(11)13/h1-4,16H,5-6H2,(H,14,15)
InChIKeyUAQYCPZSMKLLJG-UHFFFAOYSA-N
MW285.12 g/mol
LogP2.54
Rot. Bonds3

About 2-[(5-bromo-6-fluoroquinolin-2-yl)amino]ethanol

2-[(5-bromo-6-fluoroquinolin-2-yl)amino]ethanol (PubChem CID 58228014) has the molecular formula C11H10BrFN2O and a molecular weight of 285.12 g/mol. Its IUPAC name is 2-[(5-bromo-6-fluoroquinolin-2-yl)amino]ethanol.

Molecular Properties

Compound Name2-[(5-bromo-6-fluoroquinolin-2-yl)amino]ethanol
PubChem CID58228014
Molecular FormulaC11H10BrFN2O
Molecular Weight285.12 g/mol
Exact Mass284.00
IUPAC Name2-[(5-bromo-6-fluoroquinolin-2-yl)amino]ethanol
SMILESOCCNc1ccc2c(Br)c(F)ccc2n1
InChIInChI=1S/C11H10BrFN2O/c12-11-7-1-4-10(14-5-6-16)15-9(7)3-2-8(11)13/h1-4,16H,5-6H2,(H,14,15)
InChIKeyUAQYCPZSMKLLJG-UHFFFAOYSA-N
XLogP2.54
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.12
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[(5-bromo-6-fluoroquinolin-2-yl)amino]ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[(5-bromo-6-fluoroquinolin-2-yl)amino]ethanol?
The IUPAC name of 2-[(5-bromo-6-fluoroquinolin-2-yl)amino]ethanol (CID 58228014) is 2-[(5-bromo-6-fluoroquinolin-2-yl)amino]ethanol.
What is the SMILES notation for 2-[(5-bromo-6-fluoroquinolin-2-yl)amino]ethanol?
The canonical SMILES for 2-[(5-bromo-6-fluoroquinolin-2-yl)amino]ethanol is OCCNc1ccc2c(Br)c(F)ccc2n1.
What is the InChIKey of 2-[(5-bromo-6-fluoroquinolin-2-yl)amino]ethanol?
The InChIKey is UAQYCPZSMKLLJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10BrFN2O/c12-11-7-1-4-10(14-5-6-16)15-9(7)3-2-8(11)13/h1-4,16H,5-6H2,(H,14,15).
What are the key properties of 2-[(5-bromo-6-fluoroquinolin-2-yl)amino]ethanol?
2-[(5-bromo-6-fluoroquinolin-2-yl)amino]ethanol has a molecular weight of 285.12 g/mol, XLogP of 2.54, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-bromo-6-fluoroquinolin-2-yl)amino]ethanol is sourced from PubChem (CID 58228014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).