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

C24H21N5O2 — CID 67351019

IUPAC2-[2-[6-cyano-3-(2,6-dimethylanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide
SMILESCc1cccc(C)c1Nc1c(-c2ccccc2OCC(N)=O)nc2ccc(C#N)cn12
InChIInChI=1S/C24H21N5O2/c1-15-6-5-7-16(2)22(15)28-24-23(27-21-11-10-17(12-25)13-29(21)24)18-8-3-4-9-19(18)31-14-20(26)30/h3-11,13,28H,14H2,1-2H3,(H2,26,30)
InChIKeyHFRCBQFSCKVQCF-UHFFFAOYSA-N
MW411.47 g/mol
LogP4.10
Rot. Bonds6

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

2-[2-[6-cyano-3-(2,6-dimethylanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide (PubChem CID 67351019) has the molecular formula C24H21N5O2 and a molecular weight of 411.47 g/mol. Its IUPAC name is 2-[2-[6-cyano-3-(2,6-dimethylanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide.

Molecular Properties

Compound Name2-[2-[6-cyano-3-(2,6-dimethylanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide
PubChem CID67351019
Molecular FormulaC24H21N5O2
Molecular Weight411.47 g/mol
Exact Mass411.17
IUPAC Name2-[2-[6-cyano-3-(2,6-dimethylanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide
SMILESCc1cccc(C)c1Nc1c(-c2ccccc2OCC(N)=O)nc2ccc(C#N)cn12
InChIInChI=1S/C24H21N5O2/c1-15-6-5-7-16(2)22(15)28-24-23(27-21-11-10-17(12-25)13-29(21)24)18-8-3-4-9-19(18)31-14-20(26)30/h3-11,13,28H,14H2,1-2H3,(H2,26,30)
InChIKeyHFRCBQFSCKVQCF-UHFFFAOYSA-N
XLogP4.10
TPSA105.44 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500411.47
LogP ≤ 54.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[2-[6-cyano-3-(2,6-dimethylanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide?
The IUPAC name of 2-[2-[6-cyano-3-(2,6-dimethylanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide (CID 67351019) is 2-[2-[6-cyano-3-(2,6-dimethylanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide.
What is the SMILES notation for 2-[2-[6-cyano-3-(2,6-dimethylanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide?
The canonical SMILES for 2-[2-[6-cyano-3-(2,6-dimethylanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide is Cc1cccc(C)c1Nc1c(-c2ccccc2OCC(N)=O)nc2ccc(C#N)cn12.
What is the InChIKey of 2-[2-[6-cyano-3-(2,6-dimethylanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide?
The InChIKey is HFRCBQFSCKVQCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N5O2/c1-15-6-5-7-16(2)22(15)28-24-23(27-21-11-10-17(12-25)13-29(21)24)18-8-3-4-9-19(18)31-14-20(26)30/h3-11,13,28H,14H2,1-2H3,(H2,26,30).
What are the key properties of 2-[2-[6-cyano-3-(2,6-dimethylanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide?
2-[2-[6-cyano-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-[2-[6-cyano-3-(2,6-dimethylanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide is sourced from PubChem (CID 67351019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).