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

C23H20F2N2O2 — CID 134179613

IUPAC6-[4-(difluoromethoxy)phenyl]-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine
SMILESCC(C)Oc1ccc(-c2cnc3ccc(-c4ccc(OC(F)F)cc4)cn23)cc1
InChIInChI=1S/C23H20F2N2O2/c1-15(2)28-19-10-5-17(6-11-19)21-13-26-22-12-7-18(14-27(21)22)16-3-8-20(9-4-16)29-23(24)25/h3-15,23H,1-2H3
InChIKeyJQVLSHNSQDIEEQ-UHFFFAOYSA-N
MW394.42 g/mol
LogP6.06
Rot. Bonds6

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

6-[4-(difluoromethoxy)phenyl]-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine (PubChem CID 134179613) has the molecular formula C23H20F2N2O2 and a molecular weight of 394.42 g/mol. Its IUPAC name is 6-[4-(difluoromethoxy)phenyl]-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name6-[4-(difluoromethoxy)phenyl]-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine
PubChem CID134179613
Molecular FormulaC23H20F2N2O2
Molecular Weight394.42 g/mol
Exact Mass394.15
IUPAC Name6-[4-(difluoromethoxy)phenyl]-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine
SMILESCC(C)Oc1ccc(-c2cnc3ccc(-c4ccc(OC(F)F)cc4)cn23)cc1
InChIInChI=1S/C23H20F2N2O2/c1-15(2)28-19-10-5-17(6-11-19)21-13-26-22-12-7-18(14-27(21)22)16-3-8-20(9-4-16)29-23(24)25/h3-15,23H,1-2H3
InChIKeyJQVLSHNSQDIEEQ-UHFFFAOYSA-N
XLogP6.06
TPSA35.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500394.42
LogP ≤ 56.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 49836057
7-butyl-6-(4-methoxyphenyl)-5H-pyrrolo[2,3-b]pyrazine
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Methyl substituted pyrazole, 27
CID 23648674
2-(4-Methoxyphenyl)imidazo[1,2-a]pyridine
CID 694963
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CID 2876085

Frequently Asked Questions

What is the IUPAC name of 6-[4-(difluoromethoxy)phenyl]-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine?
The IUPAC name of 6-[4-(difluoromethoxy)phenyl]-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine (CID 134179613) is 6-[4-(difluoromethoxy)phenyl]-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 6-[4-(difluoromethoxy)phenyl]-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine?
The canonical SMILES for 6-[4-(difluoromethoxy)phenyl]-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine is CC(C)Oc1ccc(-c2cnc3ccc(-c4ccc(OC(F)F)cc4)cn23)cc1.
What is the InChIKey of 6-[4-(difluoromethoxy)phenyl]-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine?
The InChIKey is JQVLSHNSQDIEEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20F2N2O2/c1-15(2)28-19-10-5-17(6-11-19)21-13-26-22-12-7-18(14-27(21)22)16-3-8-20(9-4-16)29-23(24)25/h3-15,23H,1-2H3.
What are the key properties of 6-[4-(difluoromethoxy)phenyl]-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine?
6-[4-(difluoromethoxy)phenyl]-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine has a molecular weight of 394.42 g/mol, XLogP of 6.06, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(difluoromethoxy)phenyl]-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 134179613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).