2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]-N-(3-morpholin-4-ylphenyl)acetamide

C23H25N3O3 — CID 110426261

IUPAC2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]-N-(3-morpholin-4-ylphenyl)acetamide
SMILESCc1ccc(-c2nc(CC(=O)Nc3cccc(N4CCOCC4)c3)c(C)o2)cc1
InChIInChI=1S/C23H25N3O3/c1-16-6-8-18(9-7-16)23-25-21(17(2)29-23)15-22(27)24-19-4-3-5-20(14-19)26-10-12-28-13-11-26/h3-9,14H,10-13,15H2,1-2H3,(H,24,27)
InChIKeyDRBNXPOGUBOQKU-UHFFFAOYSA-N
MW391.47 g/mol
LogP3.98
Rot. Bonds5

About 2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]-N-(3-morpholin-4-ylphenyl)acetamide

2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]-N-(3-morpholin-4-ylphenyl)acetamide (PubChem CID 110426261) has the molecular formula C23H25N3O3 and a molecular weight of 391.47 g/mol. Its IUPAC name is 2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]-N-(3-morpholin-4-ylphenyl)acetamide.

Molecular Properties

Compound Name2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]-N-(3-morpholin-4-ylphenyl)acetamide
PubChem CID110426261
Molecular FormulaC23H25N3O3
Molecular Weight391.47 g/mol
Exact Mass391.19
IUPAC Name2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]-N-(3-morpholin-4-ylphenyl)acetamide
SMILESCc1ccc(-c2nc(CC(=O)Nc3cccc(N4CCOCC4)c3)c(C)o2)cc1
InChIInChI=1S/C23H25N3O3/c1-16-6-8-18(9-7-16)23-25-21(17(2)29-23)15-22(27)24-19-4-3-5-20(14-19)26-10-12-28-13-11-26/h3-9,14H,10-13,15H2,1-2H3,(H,24,27)
InChIKeyDRBNXPOGUBOQKU-UHFFFAOYSA-N
XLogP3.98
TPSA67.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.47
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,4-dimorpholin-4-ylphenyl)-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetamide
CID 112808713
2-[2-(2-fluorophenyl)-5-methyl-1,3-oxazol-4-yl]-N-(3-pyrrolidin-1-ylphenyl)acetamide
CID 110425935
2-[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]-N-(3-pyrrolidin-1-ylphenyl)acetamide
CID 110425941
2-[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]-N-(2-morpholin-4-ylphenyl)acetamide
CID 110425209
4-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]-N-(3-methylphenyl)-3-oxobutanamide
CID 126614847
2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)-N-(4-morpholin-4-ylphenyl)acetamide
CID 31046848
2-(5-methyl-1,2,4-oxadiazol-3-yl)-N-(3-morpholin-4-ylphenyl)acetamide
CID 110612977
N-(1,3-benzodioxol-5-yl)-2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]acetamide
CID 110371664
2-(5-methyl-1,2-oxazol-3-yl)-N-(3-morpholin-4-ylphenyl)acetamide
CID 110612975
N-(3-acetylphenyl)-2-[2-(4-fluorophenyl)-5-methyl-1,3-oxazol-4-yl]acetamide
CID 110371758
N-(2,4-dimorpholin-4-ylphenyl)-2-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)acetamide
CID 24627594
2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-[3-(oxan-4-ylsulfanylmethyl)phenyl]acetamide
CID 86961814

Frequently Asked Questions

What is the IUPAC name of 2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]-N-(3-morpholin-4-ylphenyl)acetamide?
The IUPAC name of 2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]-N-(3-morpholin-4-ylphenyl)acetamide (CID 110426261) is 2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]-N-(3-morpholin-4-ylphenyl)acetamide.
What is the SMILES notation for 2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]-N-(3-morpholin-4-ylphenyl)acetamide?
The canonical SMILES for 2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]-N-(3-morpholin-4-ylphenyl)acetamide is Cc1ccc(-c2nc(CC(=O)Nc3cccc(N4CCOCC4)c3)c(C)o2)cc1.
What is the InChIKey of 2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]-N-(3-morpholin-4-ylphenyl)acetamide?
The InChIKey is DRBNXPOGUBOQKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O3/c1-16-6-8-18(9-7-16)23-25-21(17(2)29-23)15-22(27)24-19-4-3-5-20(14-19)26-10-12-28-13-11-26/h3-9,14H,10-13,15H2,1-2H3,(H,24,27).
What are the key properties of 2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]-N-(3-morpholin-4-ylphenyl)acetamide?
2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]-N-(3-morpholin-4-ylphenyl)acetamide has a molecular weight of 391.47 g/mol, XLogP of 3.98, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]-N-(3-morpholin-4-ylphenyl)acetamide is sourced from PubChem (CID 110426261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).