6-bromo-7-methyl-2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine

C17H17BrN2 — CID 46307196

IUPAC6-bromo-7-methyl-2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine
SMILESCc1cc2nc(-c3ccc(C(C)C)cc3)cn2cc1Br
InChIInChI=1S/C17H17BrN2/c1-11(2)13-4-6-14(7-5-13)16-10-20-9-15(18)12(3)8-17(20)19-16/h4-11H,1-3H3
InChIKeyWEAIYEUXGROUFR-UHFFFAOYSA-N
MW329.24 g/mol
LogP5.20
Rot. Bonds2

About 6-bromo-7-methyl-2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine

6-bromo-7-methyl-2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine (PubChem CID 46307196) has the molecular formula C17H17BrN2 and a molecular weight of 329.24 g/mol. Its IUPAC name is 6-bromo-7-methyl-2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name6-bromo-7-methyl-2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine
PubChem CID46307196
Molecular FormulaC17H17BrN2
Molecular Weight329.24 g/mol
Exact Mass328.06
IUPAC Name6-bromo-7-methyl-2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine
SMILESCc1cc2nc(-c3ccc(C(C)C)cc3)cn2cc1Br
InChIInChI=1S/C17H17BrN2/c1-11(2)13-4-6-14(7-5-13)16-10-20-9-15(18)12(3)8-17(20)19-16/h4-11H,1-3H3
InChIKeyWEAIYEUXGROUFR-UHFFFAOYSA-N
XLogP5.20
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500329.24
LogP ≤ 55.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-7-methyl-2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine?
The IUPAC name of 6-bromo-7-methyl-2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine (CID 46307196) is 6-bromo-7-methyl-2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 6-bromo-7-methyl-2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine?
The canonical SMILES for 6-bromo-7-methyl-2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine is Cc1cc2nc(-c3ccc(C(C)C)cc3)cn2cc1Br.
What is the InChIKey of 6-bromo-7-methyl-2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine?
The InChIKey is WEAIYEUXGROUFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17BrN2/c1-11(2)13-4-6-14(7-5-13)16-10-20-9-15(18)12(3)8-17(20)19-16/h4-11H,1-3H3.
What are the key properties of 6-bromo-7-methyl-2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine?
6-bromo-7-methyl-2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine has a molecular weight of 329.24 g/mol, XLogP of 5.20, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-7-methyl-2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 46307196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).