2-(3-bromo-4-fluorophenyl)-8-chloroimidazo[1,2-a]pyridin-3-amine

C13H8BrClFN3 — CID 103095072

IUPAC2-(3-bromo-4-fluorophenyl)-8-chloroimidazo[1,2-a]pyridin-3-amine
SMILESNc1c(-c2ccc(F)c(Br)c2)nc2c(Cl)cccn12
InChIInChI=1S/C13H8BrClFN3/c14-8-6-7(3-4-10(8)16)11-12(17)19-5-1-2-9(15)13(19)18-11/h1-6H,17H2
InChIKeyIBHPVRKSJWMQDB-UHFFFAOYSA-N
MW340.58 g/mol
LogP4.14
Rot. Bonds1

About 2-(3-bromo-4-fluorophenyl)-8-chloroimidazo[1,2-a]pyridin-3-amine

2-(3-bromo-4-fluorophenyl)-8-chloroimidazo[1,2-a]pyridin-3-amine (PubChem CID 103095072) has the molecular formula C13H8BrClFN3 and a molecular weight of 340.58 g/mol. Its IUPAC name is 2-(3-bromo-4-fluorophenyl)-8-chloroimidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound Name2-(3-bromo-4-fluorophenyl)-8-chloroimidazo[1,2-a]pyridin-3-amine
PubChem CID103095072
Molecular FormulaC13H8BrClFN3
Molecular Weight340.58 g/mol
Exact Mass338.96
IUPAC Name2-(3-bromo-4-fluorophenyl)-8-chloroimidazo[1,2-a]pyridin-3-amine
SMILESNc1c(-c2ccc(F)c(Br)c2)nc2c(Cl)cccn12
InChIInChI=1S/C13H8BrClFN3/c14-8-6-7(3-4-10(8)16)11-12(17)19-5-1-2-9(15)13(19)18-11/h1-6H,17H2
InChIKeyIBHPVRKSJWMQDB-UHFFFAOYSA-N
XLogP4.14
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.58
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-bromo-4-fluorophenyl)-8-chloroimidazo[1,2-a]pyridin-3-amine?
The IUPAC name of 2-(3-bromo-4-fluorophenyl)-8-chloroimidazo[1,2-a]pyridin-3-amine (CID 103095072) is 2-(3-bromo-4-fluorophenyl)-8-chloroimidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for 2-(3-bromo-4-fluorophenyl)-8-chloroimidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for 2-(3-bromo-4-fluorophenyl)-8-chloroimidazo[1,2-a]pyridin-3-amine is Nc1c(-c2ccc(F)c(Br)c2)nc2c(Cl)cccn12.
What is the InChIKey of 2-(3-bromo-4-fluorophenyl)-8-chloroimidazo[1,2-a]pyridin-3-amine?
The InChIKey is IBHPVRKSJWMQDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8BrClFN3/c14-8-6-7(3-4-10(8)16)11-12(17)19-5-1-2-9(15)13(19)18-11/h1-6H,17H2.
What are the key properties of 2-(3-bromo-4-fluorophenyl)-8-chloroimidazo[1,2-a]pyridin-3-amine?
2-(3-bromo-4-fluorophenyl)-8-chloroimidazo[1,2-a]pyridin-3-amine has a molecular weight of 340.58 g/mol, XLogP of 4.14, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-bromo-4-fluorophenyl)-8-chloroimidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 103095072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).