6-bromo-2-cyclohexyl-3-(cyclohexylmethyl)imidazo[1,2-a]pyridine

C20H27BrN2 — CID 51361303

IUPAC6-bromo-2-cyclohexyl-3-(cyclohexylmethyl)imidazo[1,2-a]pyridine
SMILESBrc1ccc2nc(C3CCCCC3)c(CC3CCCCC3)n2c1
InChIInChI=1S/C20H27BrN2/c21-17-11-12-19-22-20(16-9-5-2-6-10-16)18(23(19)14-17)13-15-7-3-1-4-8-15/h11-12,14-16H,1-10,13H2
InChIKeyJIGNEQHEABVKHZ-UHFFFAOYSA-N
MW375.35 g/mol
LogP6.27
Rot. Bonds3

About 6-bromo-2-cyclohexyl-3-(cyclohexylmethyl)imidazo[1,2-a]pyridine

6-bromo-2-cyclohexyl-3-(cyclohexylmethyl)imidazo[1,2-a]pyridine (PubChem CID 51361303) has the molecular formula C20H27BrN2 and a molecular weight of 375.35 g/mol. Its IUPAC name is 6-bromo-2-cyclohexyl-3-(cyclohexylmethyl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name6-bromo-2-cyclohexyl-3-(cyclohexylmethyl)imidazo[1,2-a]pyridine
PubChem CID51361303
Molecular FormulaC20H27BrN2
Molecular Weight375.35 g/mol
Exact Mass374.14
IUPAC Name6-bromo-2-cyclohexyl-3-(cyclohexylmethyl)imidazo[1,2-a]pyridine
SMILESBrc1ccc2nc(C3CCCCC3)c(CC3CCCCC3)n2c1
InChIInChI=1S/C20H27BrN2/c21-17-11-12-19-22-20(16-9-5-2-6-10-16)18(23(19)14-17)13-15-7-3-1-4-8-15/h11-12,14-16H,1-10,13H2
InChIKeyJIGNEQHEABVKHZ-UHFFFAOYSA-N
XLogP6.27
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500375.35
LogP ≤ 56.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-2-cyclohexyl-3-(cyclohexylmethyl)imidazo[1,2-a]pyridine?
The IUPAC name of 6-bromo-2-cyclohexyl-3-(cyclohexylmethyl)imidazo[1,2-a]pyridine (CID 51361303) is 6-bromo-2-cyclohexyl-3-(cyclohexylmethyl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 6-bromo-2-cyclohexyl-3-(cyclohexylmethyl)imidazo[1,2-a]pyridine?
The canonical SMILES for 6-bromo-2-cyclohexyl-3-(cyclohexylmethyl)imidazo[1,2-a]pyridine is Brc1ccc2nc(C3CCCCC3)c(CC3CCCCC3)n2c1.
What is the InChIKey of 6-bromo-2-cyclohexyl-3-(cyclohexylmethyl)imidazo[1,2-a]pyridine?
The InChIKey is JIGNEQHEABVKHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27BrN2/c21-17-11-12-19-22-20(16-9-5-2-6-10-16)18(23(19)14-17)13-15-7-3-1-4-8-15/h11-12,14-16H,1-10,13H2.
What are the key properties of 6-bromo-2-cyclohexyl-3-(cyclohexylmethyl)imidazo[1,2-a]pyridine?
6-bromo-2-cyclohexyl-3-(cyclohexylmethyl)imidazo[1,2-a]pyridine has a molecular weight of 375.35 g/mol, XLogP of 6.27, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2-cyclohexyl-3-(cyclohexylmethyl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 51361303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).