[2-(5-bromo-2-fluorophenyl)imidazo[1,2-a]pyridin-6-yl]methanamine

C14H11BrFN3 — CID 82973931

IUPAC[2-(5-bromo-2-fluorophenyl)imidazo[1,2-a]pyridin-6-yl]methanamine
SMILESNCc1ccc2nc(-c3cc(Br)ccc3F)cn2c1
InChIInChI=1S/C14H11BrFN3/c15-10-2-3-12(16)11(5-10)13-8-19-7-9(6-17)1-4-14(19)18-13/h1-5,7-8H,6,17H2
InChIKeyDNEQAYAKZBUJCJ-UHFFFAOYSA-N
MW320.17 g/mol
LogP3.36
Rot. Bonds2

About [2-(5-bromo-2-fluorophenyl)imidazo[1,2-a]pyridin-6-yl]methanamine

[2-(5-bromo-2-fluorophenyl)imidazo[1,2-a]pyridin-6-yl]methanamine (PubChem CID 82973931) has the molecular formula C14H11BrFN3 and a molecular weight of 320.17 g/mol. Its IUPAC name is [2-(5-bromo-2-fluorophenyl)imidazo[1,2-a]pyridin-6-yl]methanamine.

Molecular Properties

Compound Name[2-(5-bromo-2-fluorophenyl)imidazo[1,2-a]pyridin-6-yl]methanamine
PubChem CID82973931
Molecular FormulaC14H11BrFN3
Molecular Weight320.17 g/mol
Exact Mass319.01
IUPAC Name[2-(5-bromo-2-fluorophenyl)imidazo[1,2-a]pyridin-6-yl]methanamine
SMILESNCc1ccc2nc(-c3cc(Br)ccc3F)cn2c1
InChIInChI=1S/C14H11BrFN3/c15-10-2-3-12(16)11(5-10)13-8-19-7-9(6-17)1-4-14(19)18-13/h1-5,7-8H,6,17H2
InChIKeyDNEQAYAKZBUJCJ-UHFFFAOYSA-N
XLogP3.36
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.17
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-(5-bromo-2-fluorophenyl)imidazo[1,2-a]pyridin-6-yl]methanamine?
The IUPAC name of [2-(5-bromo-2-fluorophenyl)imidazo[1,2-a]pyridin-6-yl]methanamine (CID 82973931) is [2-(5-bromo-2-fluorophenyl)imidazo[1,2-a]pyridin-6-yl]methanamine.
What is the SMILES notation for [2-(5-bromo-2-fluorophenyl)imidazo[1,2-a]pyridin-6-yl]methanamine?
The canonical SMILES for [2-(5-bromo-2-fluorophenyl)imidazo[1,2-a]pyridin-6-yl]methanamine is NCc1ccc2nc(-c3cc(Br)ccc3F)cn2c1.
What is the InChIKey of [2-(5-bromo-2-fluorophenyl)imidazo[1,2-a]pyridin-6-yl]methanamine?
The InChIKey is DNEQAYAKZBUJCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrFN3/c15-10-2-3-12(16)11(5-10)13-8-19-7-9(6-17)1-4-14(19)18-13/h1-5,7-8H,6,17H2.
What are the key properties of [2-(5-bromo-2-fluorophenyl)imidazo[1,2-a]pyridin-6-yl]methanamine?
[2-(5-bromo-2-fluorophenyl)imidazo[1,2-a]pyridin-6-yl]methanamine has a molecular weight of 320.17 g/mol, XLogP of 3.36, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(5-bromo-2-fluorophenyl)imidazo[1,2-a]pyridin-6-yl]methanamine is sourced from PubChem (CID 82973931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).