1-[4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]ethanone

C24H22N2O2 — CID 134179255

IUPAC1-[4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]ethanone
SMILESCC(=O)c1ccc(-c2ccc3ncc(-c4ccc(OC(C)C)cc4)n3c2)cc1
InChIInChI=1S/C24H22N2O2/c1-16(2)28-22-11-8-20(9-12-22)23-14-25-24-13-10-21(15-26(23)24)19-6-4-18(5-7-19)17(3)27/h4-16H,1-3H3
InChIKeyUHWRBWBFLBLCCE-UHFFFAOYSA-N
MW370.45 g/mol
LogP5.66
Rot. Bonds5

About 1-[4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]ethanone

1-[4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]ethanone (PubChem CID 134179255) has the molecular formula C24H22N2O2 and a molecular weight of 370.45 g/mol. Its IUPAC name is 1-[4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]ethanone.

Molecular Properties

Compound Name1-[4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]ethanone
PubChem CID134179255
Molecular FormulaC24H22N2O2
Molecular Weight370.45 g/mol
Exact Mass370.17
IUPAC Name1-[4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]ethanone
SMILESCC(=O)c1ccc(-c2ccc3ncc(-c4ccc(OC(C)C)cc4)n3c2)cc1
InChIInChI=1S/C24H22N2O2/c1-16(2)28-22-11-8-20(9-12-22)23-14-25-24-13-10-21(15-26(23)24)19-6-4-18(5-7-19)17(3)27/h4-16H,1-3H3
InChIKeyUHWRBWBFLBLCCE-UHFFFAOYSA-N
XLogP5.66
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.45
LogP ≤ 55.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]ethanone?
The IUPAC name of 1-[4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]ethanone (CID 134179255) is 1-[4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]ethanone.
What is the SMILES notation for 1-[4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]ethanone?
The canonical SMILES for 1-[4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]ethanone is CC(=O)c1ccc(-c2ccc3ncc(-c4ccc(OC(C)C)cc4)n3c2)cc1.
What is the InChIKey of 1-[4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]ethanone?
The InChIKey is UHWRBWBFLBLCCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N2O2/c1-16(2)28-22-11-8-20(9-12-22)23-14-25-24-13-10-21(15-26(23)24)19-6-4-18(5-7-19)17(3)27/h4-16H,1-3H3.
What are the key properties of 1-[4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]ethanone?
1-[4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]ethanone has a molecular weight of 370.45 g/mol, XLogP of 5.66, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]ethanone is sourced from PubChem (CID 134179255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).