2-[3-(2-methoxyethyl)-2-oxoimidazo[4,5-b]pyridin-1-yl]-N-[(3-methoxyphenyl)methyl]acetamide

C19H22N4O4 — CID 16675263

IUPAC2-[3-(2-methoxyethyl)-2-oxoimidazo[4,5-b]pyridin-1-yl]-N-[(3-methoxyphenyl)methyl]acetamide
SMILESCOCCn1c(=O)n(CC(=O)NCc2cccc(OC)c2)c2cccnc21
InChIInChI=1S/C19H22N4O4/c1-26-10-9-22-18-16(7-4-8-20-18)23(19(22)25)13-17(24)21-12-14-5-3-6-15(11-14)27-2/h3-8,11H,9-10,12-13H2,1-2H3,(H,21,24)
InChIKeyDZTGGIRNXLCSHP-UHFFFAOYSA-N
MW370.41 g/mol
LogP1.17
Rot. Bonds8

About 2-[3-(2-methoxyethyl)-2-oxoimidazo[4,5-b]pyridin-1-yl]-N-[(3-methoxyphenyl)methyl]acetamide

2-[3-(2-methoxyethyl)-2-oxoimidazo[4,5-b]pyridin-1-yl]-N-[(3-methoxyphenyl)methyl]acetamide (PubChem CID 16675263) has the molecular formula C19H22N4O4 and a molecular weight of 370.41 g/mol. Its IUPAC name is 2-[3-(2-methoxyethyl)-2-oxoimidazo[4,5-b]pyridin-1-yl]-N-[(3-methoxyphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-[3-(2-methoxyethyl)-2-oxoimidazo[4,5-b]pyridin-1-yl]-N-[(3-methoxyphenyl)methyl]acetamide
PubChem CID16675263
Molecular FormulaC19H22N4O4
Molecular Weight370.41 g/mol
Exact Mass370.16
IUPAC Name2-[3-(2-methoxyethyl)-2-oxoimidazo[4,5-b]pyridin-1-yl]-N-[(3-methoxyphenyl)methyl]acetamide
SMILESCOCCn1c(=O)n(CC(=O)NCc2cccc(OC)c2)c2cccnc21
InChIInChI=1S/C19H22N4O4/c1-26-10-9-22-18-16(7-4-8-20-18)23(19(22)25)13-17(24)21-12-14-5-3-6-15(11-14)27-2/h3-8,11H,9-10,12-13H2,1-2H3,(H,21,24)
InChIKeyDZTGGIRNXLCSHP-UHFFFAOYSA-N
XLogP1.17
TPSA87.38 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.41
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-[3-(2-methoxyethyl)-2-oxoimidazo[4,5-b]pyridin-1-yl]-N-[(3-methoxyphenyl)methyl]acetamide?
The IUPAC name of 2-[3-(2-methoxyethyl)-2-oxoimidazo[4,5-b]pyridin-1-yl]-N-[(3-methoxyphenyl)methyl]acetamide (CID 16675263) is 2-[3-(2-methoxyethyl)-2-oxoimidazo[4,5-b]pyridin-1-yl]-N-[(3-methoxyphenyl)methyl]acetamide.
What is the SMILES notation for 2-[3-(2-methoxyethyl)-2-oxoimidazo[4,5-b]pyridin-1-yl]-N-[(3-methoxyphenyl)methyl]acetamide?
The canonical SMILES for 2-[3-(2-methoxyethyl)-2-oxoimidazo[4,5-b]pyridin-1-yl]-N-[(3-methoxyphenyl)methyl]acetamide is COCCn1c(=O)n(CC(=O)NCc2cccc(OC)c2)c2cccnc21.
What is the InChIKey of 2-[3-(2-methoxyethyl)-2-oxoimidazo[4,5-b]pyridin-1-yl]-N-[(3-methoxyphenyl)methyl]acetamide?
The InChIKey is DZTGGIRNXLCSHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O4/c1-26-10-9-22-18-16(7-4-8-20-18)23(19(22)25)13-17(24)21-12-14-5-3-6-15(11-14)27-2/h3-8,11H,9-10,12-13H2,1-2H3,(H,21,24).
What are the key properties of 2-[3-(2-methoxyethyl)-2-oxoimidazo[4,5-b]pyridin-1-yl]-N-[(3-methoxyphenyl)methyl]acetamide?
2-[3-(2-methoxyethyl)-2-oxoimidazo[4,5-b]pyridin-1-yl]-N-[(3-methoxyphenyl)methyl]acetamide has a molecular weight of 370.41 g/mol, XLogP of 1.17, 8 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(2-methoxyethyl)-2-oxoimidazo[4,5-b]pyridin-1-yl]-N-[(3-methoxyphenyl)methyl]acetamide is sourced from PubChem (CID 16675263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).