2-[3-(4-methylphenyl)-2-oxoimidazo[4,5-b]pyridin-1-yl]-N-propylacetamide

C18H20N4O2 — CID 71841486

IUPAC2-[3-(4-methylphenyl)-2-oxoimidazo[4,5-b]pyridin-1-yl]-N-propylacetamide
SMILESCCCNC(=O)Cn1c(=O)n(-c2ccc(C)cc2)c2ncccc21
InChIInChI=1S/C18H20N4O2/c1-3-10-19-16(23)12-21-15-5-4-11-20-17(15)22(18(21)24)14-8-6-13(2)7-9-14/h4-9,11H,3,10,12H2,1-2H3,(H,19,23)
InChIKeyURROUSYFGXOIFC-UHFFFAOYSA-N
MW324.38 g/mol
LogP2.02
Rot. Bonds5

About 2-[3-(4-methylphenyl)-2-oxoimidazo[4,5-b]pyridin-1-yl]-N-propylacetamide

2-[3-(4-methylphenyl)-2-oxoimidazo[4,5-b]pyridin-1-yl]-N-propylacetamide (PubChem CID 71841486) has the molecular formula C18H20N4O2 and a molecular weight of 324.38 g/mol. Its IUPAC name is 2-[3-(4-methylphenyl)-2-oxoimidazo[4,5-b]pyridin-1-yl]-N-propylacetamide.

Molecular Properties

Compound Name2-[3-(4-methylphenyl)-2-oxoimidazo[4,5-b]pyridin-1-yl]-N-propylacetamide
PubChem CID71841486
Molecular FormulaC18H20N4O2
Molecular Weight324.38 g/mol
Exact Mass324.16
IUPAC Name2-[3-(4-methylphenyl)-2-oxoimidazo[4,5-b]pyridin-1-yl]-N-propylacetamide
SMILESCCCNC(=O)Cn1c(=O)n(-c2ccc(C)cc2)c2ncccc21
InChIInChI=1S/C18H20N4O2/c1-3-10-19-16(23)12-21-15-5-4-11-20-17(15)22(18(21)24)14-8-6-13(2)7-9-14/h4-9,11H,3,10,12H2,1-2H3,(H,19,23)
InChIKeyURROUSYFGXOIFC-UHFFFAOYSA-N
XLogP2.02
TPSA68.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[3-(4-methylphenyl)-2-oxoimidazo[4,5-b]pyridin-1-yl]-N-propylacetamide?
The IUPAC name of 2-[3-(4-methylphenyl)-2-oxoimidazo[4,5-b]pyridin-1-yl]-N-propylacetamide (CID 71841486) is 2-[3-(4-methylphenyl)-2-oxoimidazo[4,5-b]pyridin-1-yl]-N-propylacetamide.
What is the SMILES notation for 2-[3-(4-methylphenyl)-2-oxoimidazo[4,5-b]pyridin-1-yl]-N-propylacetamide?
The canonical SMILES for 2-[3-(4-methylphenyl)-2-oxoimidazo[4,5-b]pyridin-1-yl]-N-propylacetamide is CCCNC(=O)Cn1c(=O)n(-c2ccc(C)cc2)c2ncccc21.
What is the InChIKey of 2-[3-(4-methylphenyl)-2-oxoimidazo[4,5-b]pyridin-1-yl]-N-propylacetamide?
The InChIKey is URROUSYFGXOIFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O2/c1-3-10-19-16(23)12-21-15-5-4-11-20-17(15)22(18(21)24)14-8-6-13(2)7-9-14/h4-9,11H,3,10,12H2,1-2H3,(H,19,23).
What are the key properties of 2-[3-(4-methylphenyl)-2-oxoimidazo[4,5-b]pyridin-1-yl]-N-propylacetamide?
2-[3-(4-methylphenyl)-2-oxoimidazo[4,5-b]pyridin-1-yl]-N-propylacetamide has a molecular weight of 324.38 g/mol, XLogP of 2.02, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(4-methylphenyl)-2-oxoimidazo[4,5-b]pyridin-1-yl]-N-propylacetamide is sourced from PubChem (CID 71841486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).