3,6-dibromo-2-(4-methylphenyl)imidazo[1,2-a]pyridine

C14H10Br2N2 — CID 165178013

IUPAC3,6-dibromo-2-(4-methylphenyl)imidazo[1,2-a]pyridine
SMILESCc1ccc(-c2nc3ccc(Br)cn3c2Br)cc1
InChIInChI=1S/C14H10Br2N2/c1-9-2-4-10(5-3-9)13-14(16)18-8-11(15)6-7-12(18)17-13/h2-8H,1H3
InChIKeyDDHMFXKGHFUOTR-UHFFFAOYSA-N
MW366.06 g/mol
LogP4.83
Rot. Bonds1

About 3,6-dibromo-2-(4-methylphenyl)imidazo[1,2-a]pyridine

3,6-dibromo-2-(4-methylphenyl)imidazo[1,2-a]pyridine (PubChem CID 165178013) has the molecular formula C14H10Br2N2 and a molecular weight of 366.06 g/mol. Its IUPAC name is 3,6-dibromo-2-(4-methylphenyl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name3,6-dibromo-2-(4-methylphenyl)imidazo[1,2-a]pyridine
PubChem CID165178013
Molecular FormulaC14H10Br2N2
Molecular Weight366.06 g/mol
Exact Mass363.92
IUPAC Name3,6-dibromo-2-(4-methylphenyl)imidazo[1,2-a]pyridine
SMILESCc1ccc(-c2nc3ccc(Br)cn3c2Br)cc1
InChIInChI=1S/C14H10Br2N2/c1-9-2-4-10(5-3-9)13-14(16)18-8-11(15)6-7-12(18)17-13/h2-8H,1H3
InChIKeyDDHMFXKGHFUOTR-UHFFFAOYSA-N
XLogP4.83
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.06
LogP ≤ 54.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,6-dibromo-2-(4-methylphenyl)imidazo[1,2-a]pyridine?
The IUPAC name of 3,6-dibromo-2-(4-methylphenyl)imidazo[1,2-a]pyridine (CID 165178013) is 3,6-dibromo-2-(4-methylphenyl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 3,6-dibromo-2-(4-methylphenyl)imidazo[1,2-a]pyridine?
The canonical SMILES for 3,6-dibromo-2-(4-methylphenyl)imidazo[1,2-a]pyridine is Cc1ccc(-c2nc3ccc(Br)cn3c2Br)cc1.
What is the InChIKey of 3,6-dibromo-2-(4-methylphenyl)imidazo[1,2-a]pyridine?
The InChIKey is DDHMFXKGHFUOTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Br2N2/c1-9-2-4-10(5-3-9)13-14(16)18-8-11(15)6-7-12(18)17-13/h2-8H,1H3.
What are the key properties of 3,6-dibromo-2-(4-methylphenyl)imidazo[1,2-a]pyridine?
3,6-dibromo-2-(4-methylphenyl)imidazo[1,2-a]pyridine has a molecular weight of 366.06 g/mol, XLogP of 4.83, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-dibromo-2-(4-methylphenyl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 165178013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).