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

C24H21N5O2 — CID 67350699

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

2-[3-cyano-2-[3-(2,6-dimethylanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide (PubChem CID 67350699) has the molecular formula C24H21N5O2 and a molecular weight of 411.47 g/mol. Its IUPAC name is 2-[3-cyano-2-[3-(2,6-dimethylanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide.

Molecular Properties

• Compound Name: 2-[3-cyano-2-[3-(2,6-dimethylanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide
• PubChem CID: 67350699
• Molecular Formula: C24H21N5O2
• Molecular Weight: 411.47 g/mol
• Exact Mass: 411.17
• IUPAC Name: 2-[3-cyano-2-[3-(2,6-dimethylanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide
• SMILES: Cc1cccc(C)c1Nc1c(-c2c(C#N)cccc2OCC(N)=O)nc2ccccn12
• InChI: InChI=1S/C24H21N5O2/c1-15-7-5-8-16(2)22(15)28-24-23(27-20-11-3-4-12-29(20)24)21-17(13-25)9-6-10-18(21)31-14-19(26)30/h3-12,28H,14H2,1-2H3,(H2,26,30)
• InChIKey: CMDNXDDGLFHBKC-UHFFFAOYSA-N
• XLogP: 4.10
• TPSA: 105.44 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 6
• Rotatable Bonds: 6
• Heavy Atoms: 31
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	411.47
LogP ≤ 5	4.10
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 2-[3-cyano-2-[3-(2,6-dimethylanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide?

The IUPAC name of 2-[3-cyano-2-[3-(2,6-dimethylanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide (CID 67350699) is 2-[3-cyano-2-[3-(2,6-dimethylanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide.

What is the SMILES notation for 2-[3-cyano-2-[3-(2,6-dimethylanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide?

The canonical SMILES for 2-[3-cyano-2-[3-(2,6-dimethylanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide is Cc1cccc(C)c1Nc1c(-c2c(C#N)cccc2OCC(N)=O)nc2ccccn12.

What is the InChIKey of 2-[3-cyano-2-[3-(2,6-dimethylanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide?

The InChIKey is CMDNXDDGLFHBKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N5O2/c1-15-7-5-8-16(2)22(15)28-24-23(27-20-11-3-4-12-29(20)24)21-17(13-25)9-6-10-18(21)31-14-19(26)30/h3-12,28H,14H2,1-2H3,(H2,26,30).

What are the key properties of 2-[3-cyano-2-[3-(2,6-dimethylanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide?

2-[3-cyano-2-[3-(2,6-dimethylanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide has a molecular weight of 411.47 g/mol, XLogP of 4.10, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[3-cyano-2-[3-(2,6-dimethylanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide is sourced from PubChem (CID 67350699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).