2-cyclohexyl-6-methyl-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine

C22H23F3N2 — CID 51359993

IUPAC2-cyclohexyl-6-methyl-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine
SMILESCc1ccc2nc(C3CCCCC3)c(Cc3ccccc3C(F)(F)F)n2c1
InChIInChI=1S/C22H23F3N2/c1-15-11-12-20-26-21(16-7-3-2-4-8-16)19(27(20)14-15)13-17-9-5-6-10-18(17)22(23,24)25/h5-6,9-12,14,16H,2-4,7-8,13H2,1H3
InChIKeyLASZMKAXTIXODW-UHFFFAOYSA-N
MW372.43 g/mol
LogP6.30
Rot. Bonds3

About 2-cyclohexyl-6-methyl-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine

2-cyclohexyl-6-methyl-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine (PubChem CID 51359993) has the molecular formula C22H23F3N2 and a molecular weight of 372.43 g/mol. Its IUPAC name is 2-cyclohexyl-6-methyl-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-cyclohexyl-6-methyl-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine
PubChem CID51359993
Molecular FormulaC22H23F3N2
Molecular Weight372.43 g/mol
Exact Mass372.18
IUPAC Name2-cyclohexyl-6-methyl-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine
SMILESCc1ccc2nc(C3CCCCC3)c(Cc3ccccc3C(F)(F)F)n2c1
InChIInChI=1S/C22H23F3N2/c1-15-11-12-20-26-21(16-7-3-2-4-8-16)19(27(20)14-15)13-17-9-5-6-10-18(17)22(23,24)25/h5-6,9-12,14,16H,2-4,7-8,13H2,1H3
InChIKeyLASZMKAXTIXODW-UHFFFAOYSA-N
XLogP6.30
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.43
LogP ≤ 56.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-6-methyl-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine?
The IUPAC name of 2-cyclohexyl-6-methyl-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine (CID 51359993) is 2-cyclohexyl-6-methyl-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 2-cyclohexyl-6-methyl-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine?
The canonical SMILES for 2-cyclohexyl-6-methyl-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine is Cc1ccc2nc(C3CCCCC3)c(Cc3ccccc3C(F)(F)F)n2c1.
What is the InChIKey of 2-cyclohexyl-6-methyl-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine?
The InChIKey is LASZMKAXTIXODW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23F3N2/c1-15-11-12-20-26-21(16-7-3-2-4-8-16)19(27(20)14-15)13-17-9-5-6-10-18(17)22(23,24)25/h5-6,9-12,14,16H,2-4,7-8,13H2,1H3.
What are the key properties of 2-cyclohexyl-6-methyl-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine?
2-cyclohexyl-6-methyl-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine has a molecular weight of 372.43 g/mol, XLogP of 6.30, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-6-methyl-3-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 51359993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).