N-(imidazo[1,5-a]pyridin-3-ylmethyl)-2-[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide

C21H20N4O3 — CID 110609944

IUPACN-(imidazo[1,5-a]pyridin-3-ylmethyl)-2-[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide
SMILESCOc1ccccc1-c1nc(CC(=O)NCc2ncc3ccccn23)c(C)o1
InChIInChI=1S/C21H20N4O3/c1-14-17(24-21(28-14)16-8-3-4-9-18(16)27-2)11-20(26)23-13-19-22-12-15-7-5-6-10-25(15)19/h3-10,12H,11,13H2,1-2H3,(H,23,26)
InChIKeyYKUFPRYKZHEDQF-UHFFFAOYSA-N
MW376.42 g/mol
LogP3.17
Rot. Bonds6

About N-(imidazo[1,5-a]pyridin-3-ylmethyl)-2-[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide

N-(imidazo[1,5-a]pyridin-3-ylmethyl)-2-[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide (PubChem CID 110609944) has the molecular formula C21H20N4O3 and a molecular weight of 376.42 g/mol. Its IUPAC name is N-(imidazo[1,5-a]pyridin-3-ylmethyl)-2-[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide.

Molecular Properties

Compound NameN-(imidazo[1,5-a]pyridin-3-ylmethyl)-2-[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide
PubChem CID110609944
Molecular FormulaC21H20N4O3
Molecular Weight376.42 g/mol
Exact Mass376.15
IUPAC NameN-(imidazo[1,5-a]pyridin-3-ylmethyl)-2-[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide
SMILESCOc1ccccc1-c1nc(CC(=O)NCc2ncc3ccccn23)c(C)o1
InChIInChI=1S/C21H20N4O3/c1-14-17(24-21(28-14)16-8-3-4-9-18(16)27-2)11-20(26)23-13-19-22-12-15-7-5-6-10-25(15)19/h3-10,12H,11,13H2,1-2H3,(H,23,26)
InChIKeyYKUFPRYKZHEDQF-UHFFFAOYSA-N
XLogP3.17
TPSA81.66 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.42
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(imidazo[1,5-a]pyridin-3-ylmethyl)-2-[5-methyl-2-(2-methylphenyl)-1,3-oxazol-4-yl]acetamide
CID 110609935
2-[2-(3-fluorophenyl)-5-methyl-1,3-oxazol-4-yl]-N-(imidazo[1,5-a]pyridin-3-ylmethyl)acetamide
CID 110609939
N-[(3,4-dimethoxyphenyl)methyl]-2-[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide
CID 110412894
N-(2-methoxyphenyl)-2-[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide
CID 110421860
2-[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]-N-(2-methylsulfonylethyl)acetamide
CID 110612399
N-[2-(4-fluorophenyl)-2-oxoethyl]-2-[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide
CID 110607521
2-[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]-N-(2-thiophen-2-ylethyl)acetamide
CID 110673689
N-(4-chlorophenyl)-2-[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide
CID 110420645
N-(2,6-difluorophenyl)-2-[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide
CID 110428837
N-[4-(dimethylamino)phenyl]-2-[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide
CID 110424650
1-(3,5-dimethylmorpholin-4-yl)-2-[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]ethanone
CID 110631177
2-[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]-N-(3-pyrrolidin-1-ylphenyl)acetamide
CID 110425941

Frequently Asked Questions

What is the IUPAC name of N-(imidazo[1,5-a]pyridin-3-ylmethyl)-2-[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide?
The IUPAC name of N-(imidazo[1,5-a]pyridin-3-ylmethyl)-2-[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide (CID 110609944) is N-(imidazo[1,5-a]pyridin-3-ylmethyl)-2-[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide.
What is the SMILES notation for N-(imidazo[1,5-a]pyridin-3-ylmethyl)-2-[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide?
The canonical SMILES for N-(imidazo[1,5-a]pyridin-3-ylmethyl)-2-[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide is COc1ccccc1-c1nc(CC(=O)NCc2ncc3ccccn23)c(C)o1.
What is the InChIKey of N-(imidazo[1,5-a]pyridin-3-ylmethyl)-2-[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide?
The InChIKey is YKUFPRYKZHEDQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N4O3/c1-14-17(24-21(28-14)16-8-3-4-9-18(16)27-2)11-20(26)23-13-19-22-12-15-7-5-6-10-25(15)19/h3-10,12H,11,13H2,1-2H3,(H,23,26).
What are the key properties of N-(imidazo[1,5-a]pyridin-3-ylmethyl)-2-[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide?
N-(imidazo[1,5-a]pyridin-3-ylmethyl)-2-[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide has a molecular weight of 376.42 g/mol, XLogP of 3.17, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(imidazo[1,5-a]pyridin-3-ylmethyl)-2-[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide is sourced from PubChem (CID 110609944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).