2-[2-(2,4-dimethoxyphenyl)imidazo[4,5-b]pyridin-3-yl]-N-(2,4,6-trimethylphenyl)acetamide

C25H26N4O3 — CID 44528650

IUPAC2-[2-(2,4-dimethoxyphenyl)imidazo[4,5-b]pyridin-3-yl]-N-(2,4,6-trimethylphenyl)acetamide
SMILESCOc1ccc(-c2nc3cccnc3n2CC(=O)Nc2c(C)cc(C)cc2C)c(OC)c1
InChIInChI=1S/C25H26N4O3/c1-15-11-16(2)23(17(3)12-15)28-22(30)14-29-24(27-20-7-6-10-26-25(20)29)19-9-8-18(31-4)13-21(19)32-5/h6-13H,14H2,1-5H3,(H,28,30)
InChIKeyGNRORAYYERBADK-UHFFFAOYSA-N
MW430.51 g/mol
LogP4.68
Rot. Bonds6

About 2-[2-(2,4-dimethoxyphenyl)imidazo[4,5-b]pyridin-3-yl]-N-(2,4,6-trimethylphenyl)acetamide

2-[2-(2,4-dimethoxyphenyl)imidazo[4,5-b]pyridin-3-yl]-N-(2,4,6-trimethylphenyl)acetamide (PubChem CID 44528650) has the molecular formula C25H26N4O3 and a molecular weight of 430.51 g/mol. Its IUPAC name is 2-[2-(2,4-dimethoxyphenyl)imidazo[4,5-b]pyridin-3-yl]-N-(2,4,6-trimethylphenyl)acetamide.

Molecular Properties

Compound Name2-[2-(2,4-dimethoxyphenyl)imidazo[4,5-b]pyridin-3-yl]-N-(2,4,6-trimethylphenyl)acetamide
PubChem CID44528650
Molecular FormulaC25H26N4O3
Molecular Weight430.51 g/mol
Exact Mass430.20
IUPAC Name2-[2-(2,4-dimethoxyphenyl)imidazo[4,5-b]pyridin-3-yl]-N-(2,4,6-trimethylphenyl)acetamide
SMILESCOc1ccc(-c2nc3cccnc3n2CC(=O)Nc2c(C)cc(C)cc2C)c(OC)c1
InChIInChI=1S/C25H26N4O3/c1-15-11-16(2)23(17(3)12-15)28-22(30)14-29-24(27-20-7-6-10-26-25(20)29)19-9-8-18(31-4)13-21(19)32-5/h6-13H,14H2,1-5H3,(H,28,30)
InChIKeyGNRORAYYERBADK-UHFFFAOYSA-N
XLogP4.68
TPSA78.27 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.51
LogP ≤ 54.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(2,4-dimethoxyphenyl)imidazo[4,5-b]pyridin-3-yl]-N-(2,4,6-trimethylphenyl)acetamide?
The IUPAC name of 2-[2-(2,4-dimethoxyphenyl)imidazo[4,5-b]pyridin-3-yl]-N-(2,4,6-trimethylphenyl)acetamide (CID 44528650) is 2-[2-(2,4-dimethoxyphenyl)imidazo[4,5-b]pyridin-3-yl]-N-(2,4,6-trimethylphenyl)acetamide.
What is the SMILES notation for 2-[2-(2,4-dimethoxyphenyl)imidazo[4,5-b]pyridin-3-yl]-N-(2,4,6-trimethylphenyl)acetamide?
The canonical SMILES for 2-[2-(2,4-dimethoxyphenyl)imidazo[4,5-b]pyridin-3-yl]-N-(2,4,6-trimethylphenyl)acetamide is COc1ccc(-c2nc3cccnc3n2CC(=O)Nc2c(C)cc(C)cc2C)c(OC)c1.
What is the InChIKey of 2-[2-(2,4-dimethoxyphenyl)imidazo[4,5-b]pyridin-3-yl]-N-(2,4,6-trimethylphenyl)acetamide?
The InChIKey is GNRORAYYERBADK-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N4O3/c1-15-11-16(2)23(17(3)12-15)28-22(30)14-29-24(27-20-7-6-10-26-25(20)29)19-9-8-18(31-4)13-21(19)32-5/h6-13H,14H2,1-5H3,(H,28,30).
What are the key properties of 2-[2-(2,4-dimethoxyphenyl)imidazo[4,5-b]pyridin-3-yl]-N-(2,4,6-trimethylphenyl)acetamide?
2-[2-(2,4-dimethoxyphenyl)imidazo[4,5-b]pyridin-3-yl]-N-(2,4,6-trimethylphenyl)acetamide has a molecular weight of 430.51 g/mol, XLogP of 4.68, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2,4-dimethoxyphenyl)imidazo[4,5-b]pyridin-3-yl]-N-(2,4,6-trimethylphenyl)acetamide is sourced from PubChem (CID 44528650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).