3-[4-(difluoromethyl)phenyl]-6-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine

C23H20F2N2O — CID 134179303

IUPAC3-[4-(difluoromethyl)phenyl]-6-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine
SMILESCC(C)Oc1ccc(-c2ccc3ncc(-c4ccc(C(F)F)cc4)n3c2)cc1
InChIInChI=1S/C23H20F2N2O/c1-15(2)28-20-10-7-16(8-11-20)19-9-12-22-26-13-21(27(22)14-19)17-3-5-18(6-4-17)23(24)25/h3-15,23H,1-2H3
InChIKeyXEWGEJGORZYQJD-UHFFFAOYSA-N
MW378.42 g/mol
LogP6.39
Rot. Bonds5

About 3-[4-(difluoromethyl)phenyl]-6-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine

3-[4-(difluoromethyl)phenyl]-6-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine (PubChem CID 134179303) has the molecular formula C23H20F2N2O and a molecular weight of 378.42 g/mol. Its IUPAC name is 3-[4-(difluoromethyl)phenyl]-6-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name3-[4-(difluoromethyl)phenyl]-6-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine
PubChem CID134179303
Molecular FormulaC23H20F2N2O
Molecular Weight378.42 g/mol
Exact Mass378.15
IUPAC Name3-[4-(difluoromethyl)phenyl]-6-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine
SMILESCC(C)Oc1ccc(-c2ccc3ncc(-c4ccc(C(F)F)cc4)n3c2)cc1
InChIInChI=1S/C23H20F2N2O/c1-15(2)28-20-10-7-16(8-11-20)19-9-12-22-26-13-21(27(22)14-19)17-3-5-18(6-4-17)23(24)25/h3-15,23H,1-2H3
InChIKeyXEWGEJGORZYQJD-UHFFFAOYSA-N
XLogP6.39
TPSA26.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500378.42
LogP ≤ 56.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[4-(difluoromethyl)phenyl]-6-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine?
The IUPAC name of 3-[4-(difluoromethyl)phenyl]-6-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine (CID 134179303) is 3-[4-(difluoromethyl)phenyl]-6-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 3-[4-(difluoromethyl)phenyl]-6-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine?
The canonical SMILES for 3-[4-(difluoromethyl)phenyl]-6-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine is CC(C)Oc1ccc(-c2ccc3ncc(-c4ccc(C(F)F)cc4)n3c2)cc1.
What is the InChIKey of 3-[4-(difluoromethyl)phenyl]-6-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine?
The InChIKey is XEWGEJGORZYQJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20F2N2O/c1-15(2)28-20-10-7-16(8-11-20)19-9-12-22-26-13-21(27(22)14-19)17-3-5-18(6-4-17)23(24)25/h3-15,23H,1-2H3.
What are the key properties of 3-[4-(difluoromethyl)phenyl]-6-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine?
3-[4-(difluoromethyl)phenyl]-6-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine has a molecular weight of 378.42 g/mol, XLogP of 6.39, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(difluoromethyl)phenyl]-6-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 134179303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).