2-[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]-N-(4-phenylbutan-2-yl)acetamide

C22H24N2O3 — CID 16878971

IUPAC2-[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]-N-(4-phenylbutan-2-yl)acetamide
SMILESCOc1cccc(-c2cc(CC(=O)NC(C)CCc3ccccc3)no2)c1
InChIInChI=1S/C22H24N2O3/c1-16(11-12-17-7-4-3-5-8-17)23-22(25)15-19-14-21(27-24-19)18-9-6-10-20(13-18)26-2/h3-10,13-14,16H,11-12,15H2,1-2H3,(H,23,25)
InChIKeyZXPHRDAIUOWPBM-UHFFFAOYSA-N
MW364.45 g/mol
LogP4.03
Rot. Bonds8

About 2-[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]-N-(4-phenylbutan-2-yl)acetamide

2-[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]-N-(4-phenylbutan-2-yl)acetamide (PubChem CID 16878971) has the molecular formula C22H24N2O3 and a molecular weight of 364.45 g/mol. Its IUPAC name is 2-[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]-N-(4-phenylbutan-2-yl)acetamide.

Molecular Properties

Compound Name2-[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]-N-(4-phenylbutan-2-yl)acetamide
PubChem CID16878971
Molecular FormulaC22H24N2O3
Molecular Weight364.45 g/mol
Exact Mass364.18
IUPAC Name2-[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]-N-(4-phenylbutan-2-yl)acetamide
SMILESCOc1cccc(-c2cc(CC(=O)NC(C)CCc3ccccc3)no2)c1
InChIInChI=1S/C22H24N2O3/c1-16(11-12-17-7-4-3-5-8-17)23-22(25)15-19-14-21(27-24-19)18-9-6-10-20(13-18)26-2/h3-10,13-14,16H,11-12,15H2,1-2H3,(H,23,25)
InChIKeyZXPHRDAIUOWPBM-UHFFFAOYSA-N
XLogP4.03
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]ethyl]-2-phenylacetamide
CID 110314800
2-[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]-N-(4-phenoxyphenyl)acetamide
CID 16879011
N-butan-2-yl-2-(5-phenyl-1,2-oxazol-3-yl)acetamide
CID 16878276
N-[2-[4-(dimethylamino)phenyl]ethyl]-2-[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]acetamide
CID 110313446
2-[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]-N-(4-methylphenyl)acetamide
CID 16878981
2-[[2-[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]acetyl]amino]benzamide
CID 16879078
N-(3-acetamidopropyl)-2-[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]acetamide
CID 110313759
N-(3-acetylphenyl)-2-[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]acetamide
CID 16879006
2-[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]-N-(3,4,5-trimethoxyphenyl)acetamide
CID 110316742
N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]acetamide
CID 110619481
N-[3-(dimethylamino)propyl]-2-[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]acetamide
CID 16878943
2-[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]-N-(2-methylcyclohexyl)acetamide
CID 16878951

Frequently Asked Questions

What is the IUPAC name of 2-[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]-N-(4-phenylbutan-2-yl)acetamide?
The IUPAC name of 2-[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]-N-(4-phenylbutan-2-yl)acetamide (CID 16878971) is 2-[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]-N-(4-phenylbutan-2-yl)acetamide.
What is the SMILES notation for 2-[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]-N-(4-phenylbutan-2-yl)acetamide?
The canonical SMILES for 2-[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]-N-(4-phenylbutan-2-yl)acetamide is COc1cccc(-c2cc(CC(=O)NC(C)CCc3ccccc3)no2)c1.
What is the InChIKey of 2-[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]-N-(4-phenylbutan-2-yl)acetamide?
The InChIKey is ZXPHRDAIUOWPBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O3/c1-16(11-12-17-7-4-3-5-8-17)23-22(25)15-19-14-21(27-24-19)18-9-6-10-20(13-18)26-2/h3-10,13-14,16H,11-12,15H2,1-2H3,(H,23,25).
What are the key properties of 2-[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]-N-(4-phenylbutan-2-yl)acetamide?
2-[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]-N-(4-phenylbutan-2-yl)acetamide has a molecular weight of 364.45 g/mol, XLogP of 4.03, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]-N-(4-phenylbutan-2-yl)acetamide is sourced from PubChem (CID 16878971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).