N-(6-bromo-7-methylimidazo[1,2-a]pyridin-2-yl)-2,2,2-trifluoroacetamide

C10H7BrF3N3O — CID 129319732

IUPACN-(6-bromo-7-methylimidazo[1,2-a]pyridin-2-yl)-2,2,2-trifluoroacetamide
SMILESCc1cc2nc(NC(=O)C(F)(F)F)cn2cc1Br
InChIInChI=1S/C10H7BrF3N3O/c1-5-2-8-15-7(4-17(8)3-6(5)11)16-9(18)10(12,13)14/h2-4H,1H3,(H,16,18)
InChIKeyYOBOUFFKEQEZFF-UHFFFAOYSA-N
MW322.08 g/mol
LogP2.91
Rot. Bonds1

About N-(6-bromo-7-methylimidazo[1,2-a]pyridin-2-yl)-2,2,2-trifluoroacetamide

N-(6-bromo-7-methylimidazo[1,2-a]pyridin-2-yl)-2,2,2-trifluoroacetamide (PubChem CID 129319732) has the molecular formula C10H7BrF3N3O and a molecular weight of 322.08 g/mol. Its IUPAC name is N-(6-bromo-7-methylimidazo[1,2-a]pyridin-2-yl)-2,2,2-trifluoroacetamide.

Molecular Properties

Compound NameN-(6-bromo-7-methylimidazo[1,2-a]pyridin-2-yl)-2,2,2-trifluoroacetamide
PubChem CID129319732
Molecular FormulaC10H7BrF3N3O
Molecular Weight322.08 g/mol
Exact Mass320.97
IUPAC NameN-(6-bromo-7-methylimidazo[1,2-a]pyridin-2-yl)-2,2,2-trifluoroacetamide
SMILESCc1cc2nc(NC(=O)C(F)(F)F)cn2cc1Br
InChIInChI=1S/C10H7BrF3N3O/c1-5-2-8-15-7(4-17(8)3-6(5)11)16-9(18)10(12,13)14/h2-4H,1H3,(H,16,18)
InChIKeyYOBOUFFKEQEZFF-UHFFFAOYSA-N
XLogP2.91
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.08
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(6-bromo-7-methylimidazo[1,2-a]pyridin-2-yl)-2,2,2-trifluoroacetamide?
The IUPAC name of N-(6-bromo-7-methylimidazo[1,2-a]pyridin-2-yl)-2,2,2-trifluoroacetamide (CID 129319732) is N-(6-bromo-7-methylimidazo[1,2-a]pyridin-2-yl)-2,2,2-trifluoroacetamide.
What is the SMILES notation for N-(6-bromo-7-methylimidazo[1,2-a]pyridin-2-yl)-2,2,2-trifluoroacetamide?
The canonical SMILES for N-(6-bromo-7-methylimidazo[1,2-a]pyridin-2-yl)-2,2,2-trifluoroacetamide is Cc1cc2nc(NC(=O)C(F)(F)F)cn2cc1Br.
What is the InChIKey of N-(6-bromo-7-methylimidazo[1,2-a]pyridin-2-yl)-2,2,2-trifluoroacetamide?
The InChIKey is YOBOUFFKEQEZFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7BrF3N3O/c1-5-2-8-15-7(4-17(8)3-6(5)11)16-9(18)10(12,13)14/h2-4H,1H3,(H,16,18).
What are the key properties of N-(6-bromo-7-methylimidazo[1,2-a]pyridin-2-yl)-2,2,2-trifluoroacetamide?
N-(6-bromo-7-methylimidazo[1,2-a]pyridin-2-yl)-2,2,2-trifluoroacetamide has a molecular weight of 322.08 g/mol, XLogP of 2.91, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-bromo-7-methylimidazo[1,2-a]pyridin-2-yl)-2,2,2-trifluoroacetamide is sourced from PubChem (CID 129319732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).