2,3-ditert-butyl-6,7-dichloroimidazo[1,2-a]pyridine

C15H20Cl2N2 — CID 59176743

IUPAC2,3-ditert-butyl-6,7-dichloroimidazo[1,2-a]pyridine
SMILESCC(C)(C)c1nc2cc(Cl)c(Cl)cn2c1C(C)(C)C
InChIInChI=1S/C15H20Cl2N2/c1-14(2,3)12-13(15(4,5)6)19-8-10(17)9(16)7-11(19)18-12/h7-8H,1-6H3
InChIKeyHHILDGMNOAHVSX-UHFFFAOYSA-N
MW299.25 g/mol
LogP5.24
Rot. Bonds

About 2,3-ditert-butyl-6,7-dichloroimidazo[1,2-a]pyridine

2,3-ditert-butyl-6,7-dichloroimidazo[1,2-a]pyridine (PubChem CID 59176743) has the molecular formula C15H20Cl2N2 and a molecular weight of 299.25 g/mol. Its IUPAC name is 2,3-ditert-butyl-6,7-dichloroimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2,3-ditert-butyl-6,7-dichloroimidazo[1,2-a]pyridine
PubChem CID59176743
Molecular FormulaC15H20Cl2N2
Molecular Weight299.25 g/mol
Exact Mass298.10
IUPAC Name2,3-ditert-butyl-6,7-dichloroimidazo[1,2-a]pyridine
SMILESCC(C)(C)c1nc2cc(Cl)c(Cl)cn2c1C(C)(C)C
InChIInChI=1S/C15H20Cl2N2/c1-14(2,3)12-13(15(4,5)6)19-8-10(17)9(16)7-11(19)18-12/h7-8H,1-6H3
InChIKeyHHILDGMNOAHVSX-UHFFFAOYSA-N
XLogP5.24
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500299.25
LogP ≤ 55.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3-ditert-butyl-6,7-dichloroimidazo[1,2-a]pyridine?
The IUPAC name of 2,3-ditert-butyl-6,7-dichloroimidazo[1,2-a]pyridine (CID 59176743) is 2,3-ditert-butyl-6,7-dichloroimidazo[1,2-a]pyridine.
What is the SMILES notation for 2,3-ditert-butyl-6,7-dichloroimidazo[1,2-a]pyridine?
The canonical SMILES for 2,3-ditert-butyl-6,7-dichloroimidazo[1,2-a]pyridine is CC(C)(C)c1nc2cc(Cl)c(Cl)cn2c1C(C)(C)C.
What is the InChIKey of 2,3-ditert-butyl-6,7-dichloroimidazo[1,2-a]pyridine?
The InChIKey is HHILDGMNOAHVSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20Cl2N2/c1-14(2,3)12-13(15(4,5)6)19-8-10(17)9(16)7-11(19)18-12/h7-8H,1-6H3.
What are the key properties of 2,3-ditert-butyl-6,7-dichloroimidazo[1,2-a]pyridine?
2,3-ditert-butyl-6,7-dichloroimidazo[1,2-a]pyridine has a molecular weight of 299.25 g/mol, XLogP of 5.24, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-ditert-butyl-6,7-dichloroimidazo[1,2-a]pyridine is sourced from PubChem (CID 59176743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).