[2-(2-bromo-4-fluorophenoxy)imidazo[1,2-a]pyridin-3-yl]methanamine

C14H11BrFN3O — CID 43478652

IUPAC[2-(2-bromo-4-fluorophenoxy)imidazo[1,2-a]pyridin-3-yl]methanamine
SMILESNCc1c(Oc2ccc(F)cc2Br)nc2ccccn12
InChIInChI=1S/C14H11BrFN3O/c15-10-7-9(16)4-5-12(10)20-14-11(8-17)19-6-2-1-3-13(19)18-14/h1-7H,8,17H2
InChIKeyMPPAINPGDWJQPA-UHFFFAOYSA-N
MW336.16 g/mol
LogP3.49
Rot. Bonds3

About [2-(2-bromo-4-fluorophenoxy)imidazo[1,2-a]pyridin-3-yl]methanamine

[2-(2-bromo-4-fluorophenoxy)imidazo[1,2-a]pyridin-3-yl]methanamine (PubChem CID 43478652) has the molecular formula C14H11BrFN3O and a molecular weight of 336.16 g/mol. Its IUPAC name is [2-(2-bromo-4-fluorophenoxy)imidazo[1,2-a]pyridin-3-yl]methanamine.

Molecular Properties

Compound Name[2-(2-bromo-4-fluorophenoxy)imidazo[1,2-a]pyridin-3-yl]methanamine
PubChem CID43478652
Molecular FormulaC14H11BrFN3O
Molecular Weight336.16 g/mol
Exact Mass335.01
IUPAC Name[2-(2-bromo-4-fluorophenoxy)imidazo[1,2-a]pyridin-3-yl]methanamine
SMILESNCc1c(Oc2ccc(F)cc2Br)nc2ccccn12
InChIInChI=1S/C14H11BrFN3O/c15-10-7-9(16)4-5-12(10)20-14-11(8-17)19-6-2-1-3-13(19)18-14/h1-7H,8,17H2
InChIKeyMPPAINPGDWJQPA-UHFFFAOYSA-N
XLogP3.49
TPSA52.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.16
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-(3-bromo-5-fluorophenoxy)imidazo[1,2-a]pyridin-3-yl]methanamine
CID 81332235
[2-(2-methylphenoxy)imidazo[1,2-a]pyridin-3-yl]methanamine
CID 43478692
[2-(5-bromo-2-methylphenoxy)imidazo[1,2-a]pyridin-3-yl]methanamine
CID 107285108
[2-(2-bromo-4-fluorophenoxy)quinolin-3-yl]methanamine
CID 28965989
[2-(3-fluoro-4-methylphenoxy)imidazo[1,2-a]pyridin-3-yl]methanamine
CID 107169942
1-[2-(2-bromo-4-chlorophenoxy)imidazo[1,2-a]pyridin-3-yl]-N-methylmethanamine
CID 43478720
[2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]imidazo[1,2-a]pyridin-3-yl]methanamine
CID 103175247
1-[2-(2,5-difluorophenoxy)imidazo[1,2-a]pyridin-3-yl]-N-methylmethanamine
CID 63269750
2-(5-bromo-2-fluorophenoxy)-3-(chloromethyl)imidazo[1,2-a]pyridine
CID 114674035
[2-(3-methoxyphenoxy)imidazo[1,2-a]pyridin-3-yl]methanamine
CID 43478666
[2-(3,4-dimethylphenoxy)imidazo[1,2-a]pyridin-3-yl]methanamine
CID 43478684
2-(5-bromo-2,3-difluorophenoxy)-3-(chloromethyl)imidazo[1,2-a]pyridine
CID 107100284

Frequently Asked Questions

What is the IUPAC name of [2-(2-bromo-4-fluorophenoxy)imidazo[1,2-a]pyridin-3-yl]methanamine?
The IUPAC name of [2-(2-bromo-4-fluorophenoxy)imidazo[1,2-a]pyridin-3-yl]methanamine (CID 43478652) is [2-(2-bromo-4-fluorophenoxy)imidazo[1,2-a]pyridin-3-yl]methanamine.
What is the SMILES notation for [2-(2-bromo-4-fluorophenoxy)imidazo[1,2-a]pyridin-3-yl]methanamine?
The canonical SMILES for [2-(2-bromo-4-fluorophenoxy)imidazo[1,2-a]pyridin-3-yl]methanamine is NCc1c(Oc2ccc(F)cc2Br)nc2ccccn12.
What is the InChIKey of [2-(2-bromo-4-fluorophenoxy)imidazo[1,2-a]pyridin-3-yl]methanamine?
The InChIKey is MPPAINPGDWJQPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrFN3O/c15-10-7-9(16)4-5-12(10)20-14-11(8-17)19-6-2-1-3-13(19)18-14/h1-7H,8,17H2.
What are the key properties of [2-(2-bromo-4-fluorophenoxy)imidazo[1,2-a]pyridin-3-yl]methanamine?
[2-(2-bromo-4-fluorophenoxy)imidazo[1,2-a]pyridin-3-yl]methanamine has a molecular weight of 336.16 g/mol, XLogP of 3.49, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-bromo-4-fluorophenoxy)imidazo[1,2-a]pyridin-3-yl]methanamine is sourced from PubChem (CID 43478652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).