2-[2-[3-(2,6-dichloroanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide

C21H16Cl2N4O2 — CID 24855040

IUPAC2-[2-[3-(2,6-dichloroanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide
SMILESNC(=O)COc1ccccc1-c1nc2ccccn2c1Nc1c(Cl)cccc1Cl
InChIInChI=1S/C21H16Cl2N4O2/c22-14-7-5-8-15(23)20(14)26-21-19(25-18-10-3-4-11-27(18)21)13-6-1-2-9-16(13)29-12-17(24)28/h1-11,26H,12H2,(H2,24,28)
InChIKeyOIYKPLMOGHSDKS-UHFFFAOYSA-N
MW427.29 g/mol
LogP4.92
Rot. Bonds6

About 2-[2-[3-(2,6-dichloroanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide

2-[2-[3-(2,6-dichloroanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide (PubChem CID 24855040) has the molecular formula C21H16Cl2N4O2 and a molecular weight of 427.29 g/mol. Its IUPAC name is 2-[2-[3-(2,6-dichloroanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide.

Molecular Properties

Compound Name2-[2-[3-(2,6-dichloroanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide
PubChem CID24855040
Molecular FormulaC21H16Cl2N4O2
Molecular Weight427.29 g/mol
Exact Mass426.07
IUPAC Name2-[2-[3-(2,6-dichloroanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide
SMILESNC(=O)COc1ccccc1-c1nc2ccccn2c1Nc1c(Cl)cccc1Cl
InChIInChI=1S/C21H16Cl2N4O2/c22-14-7-5-8-15(23)20(14)26-21-19(25-18-10-3-4-11-27(18)21)13-6-1-2-9-16(13)29-12-17(24)28/h1-11,26H,12H2,(H2,24,28)
InChIKeyOIYKPLMOGHSDKS-UHFFFAOYSA-N
XLogP4.92
TPSA81.65 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500427.29
LogP ≤ 54.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[2-[3-(2,6-dichloroanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide?
The IUPAC name of 2-[2-[3-(2,6-dichloroanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide (CID 24855040) is 2-[2-[3-(2,6-dichloroanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide.
What is the SMILES notation for 2-[2-[3-(2,6-dichloroanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide?
The canonical SMILES for 2-[2-[3-(2,6-dichloroanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide is NC(=O)COc1ccccc1-c1nc2ccccn2c1Nc1c(Cl)cccc1Cl.
What is the InChIKey of 2-[2-[3-(2,6-dichloroanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide?
The InChIKey is OIYKPLMOGHSDKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16Cl2N4O2/c22-14-7-5-8-15(23)20(14)26-21-19(25-18-10-3-4-11-27(18)21)13-6-1-2-9-16(13)29-12-17(24)28/h1-11,26H,12H2,(H2,24,28).
What are the key properties of 2-[2-[3-(2,6-dichloroanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide?
2-[2-[3-(2,6-dichloroanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide has a molecular weight of 427.29 g/mol, XLogP of 4.92, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[3-(2,6-dichloroanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide is sourced from PubChem (CID 24855040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).