1-[3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]ethanol

C21H17ClN2O — CID 67046247

IUPAC1-[3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]ethanol
SMILESCC(O)c1cccc(-c2ccc3nc(-c4ccc(Cl)cc4)cn3c2)c1
InChIInChI=1S/C21H17ClN2O/c1-14(25)16-3-2-4-17(11-16)18-7-10-21-23-20(13-24(21)12-18)15-5-8-19(22)9-6-15/h2-14,25H,1H3
InChIKeyMYONEJYVJVQVAF-UHFFFAOYSA-N
MW348.83 g/mol
LogP5.38
Rot. Bonds3

About 1-[3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]ethanol

1-[3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]ethanol (PubChem CID 67046247) has the molecular formula C21H17ClN2O and a molecular weight of 348.83 g/mol. Its IUPAC name is 1-[3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]ethanol.

Molecular Properties

Compound Name1-[3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]ethanol
PubChem CID67046247
Molecular FormulaC21H17ClN2O
Molecular Weight348.83 g/mol
Exact Mass348.10
IUPAC Name1-[3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]ethanol
SMILESCC(O)c1cccc(-c2ccc3nc(-c4ccc(Cl)cc4)cn3c2)c1
InChIInChI=1S/C21H17ClN2O/c1-14(25)16-3-2-4-17(11-16)18-7-10-21-23-20(13-24(21)12-18)15-5-8-19(22)9-6-15/h2-14,25H,1H3
InChIKeyMYONEJYVJVQVAF-UHFFFAOYSA-N
XLogP5.38
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500348.83
LogP ≤ 55.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]ethanol?
The IUPAC name of 1-[3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]ethanol (CID 67046247) is 1-[3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]ethanol.
What is the SMILES notation for 1-[3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]ethanol?
The canonical SMILES for 1-[3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]ethanol is CC(O)c1cccc(-c2ccc3nc(-c4ccc(Cl)cc4)cn3c2)c1.
What is the InChIKey of 1-[3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]ethanol?
The InChIKey is MYONEJYVJVQVAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17ClN2O/c1-14(25)16-3-2-4-17(11-16)18-7-10-21-23-20(13-24(21)12-18)15-5-8-19(22)9-6-15/h2-14,25H,1H3.
What are the key properties of 1-[3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]ethanol?
1-[3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]ethanol has a molecular weight of 348.83 g/mol, XLogP of 5.38, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]ethanol is sourced from PubChem (CID 67046247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).