3-(2-methyl-1,3-oxazol-4-yl)-N-(3,4,5-trimethoxyphenyl)propanamide

C16H20N2O5 — CID 110679342

IUPAC3-(2-methyl-1,3-oxazol-4-yl)-N-(3,4,5-trimethoxyphenyl)propanamide
SMILESCOc1cc(NC(=O)CCc2coc(C)n2)cc(OC)c1OC
InChIInChI=1S/C16H20N2O5/c1-10-17-11(9-23-10)5-6-15(19)18-12-7-13(20-2)16(22-4)14(8-12)21-3/h7-9H,5-6H2,1-4H3,(H,18,19)
InChIKeyHUQKJNIOGAOUEO-UHFFFAOYSA-N
MW320.35 g/mol
LogP2.58
Rot. Bonds7

About 3-(2-methyl-1,3-oxazol-4-yl)-N-(3,4,5-trimethoxyphenyl)propanamide

3-(2-methyl-1,3-oxazol-4-yl)-N-(3,4,5-trimethoxyphenyl)propanamide (PubChem CID 110679342) has the molecular formula C16H20N2O5 and a molecular weight of 320.35 g/mol. Its IUPAC name is 3-(2-methyl-1,3-oxazol-4-yl)-N-(3,4,5-trimethoxyphenyl)propanamide.

Molecular Properties

Compound Name3-(2-methyl-1,3-oxazol-4-yl)-N-(3,4,5-trimethoxyphenyl)propanamide
PubChem CID110679342
Molecular FormulaC16H20N2O5
Molecular Weight320.35 g/mol
Exact Mass320.14
IUPAC Name3-(2-methyl-1,3-oxazol-4-yl)-N-(3,4,5-trimethoxyphenyl)propanamide
SMILESCOc1cc(NC(=O)CCc2coc(C)n2)cc(OC)c1OC
InChIInChI=1S/C16H20N2O5/c1-10-17-11(9-23-10)5-6-15(19)18-12-7-13(20-2)16(22-4)14(8-12)21-3/h7-9H,5-6H2,1-4H3,(H,18,19)
InChIKeyHUQKJNIOGAOUEO-UHFFFAOYSA-N
XLogP2.58
TPSA82.82 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.35
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2,5-dimethoxyphenyl)-3-(2-methyl-1,3-oxazol-4-yl)propanamide
CID 110679301
3-(4-methoxyphenyl)-N-(3,4,5-trimethoxyphenyl)propanamide
CID 7741638
N-(3,4,5-trimethoxyphenyl)-3-(1,3,5-trimethylpyrazol-4-yl)propanamide
CID 17499400
4-(4-methoxyphenyl)-4-oxo-N-(3,4,5-trimethoxyphenyl)butanamide
CID 49017115
3-phenyl-N-(3,4,5-trimethoxyphenyl)propanamide
CID 2991890
N-[(4-methoxyphenyl)methyl]-3-(2-methyl-1,3-oxazol-4-yl)propanamide
CID 110679194
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2-methyl-1,3-oxazol-4-yl)propanamide
CID 110679338
3-(3,4-dimethoxyphenyl)-N-[(2-methyl-1,3-oxazol-4-yl)methyl]propanamide
CID 110742436
N-(2,4-dimethylphenyl)-3-(2-methyl-1,3-oxazol-4-yl)propanamide
CID 110679261
3-[2-(3,5-dimethoxyphenyl)-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-(3,4,5-trimethoxyphenyl)propanamide
CID 20863546
N'-(5-methyl-1,2-oxazol-3-yl)-N-(3,4,5-trimethoxyphenyl)propanediamide
CID 108956802
2-(propylsulfonylamino)-N-(3,4,5-trimethoxyphenyl)acetamide
CID 113000933

Frequently Asked Questions

What is the IUPAC name of 3-(2-methyl-1,3-oxazol-4-yl)-N-(3,4,5-trimethoxyphenyl)propanamide?
The IUPAC name of 3-(2-methyl-1,3-oxazol-4-yl)-N-(3,4,5-trimethoxyphenyl)propanamide (CID 110679342) is 3-(2-methyl-1,3-oxazol-4-yl)-N-(3,4,5-trimethoxyphenyl)propanamide.
What is the SMILES notation for 3-(2-methyl-1,3-oxazol-4-yl)-N-(3,4,5-trimethoxyphenyl)propanamide?
The canonical SMILES for 3-(2-methyl-1,3-oxazol-4-yl)-N-(3,4,5-trimethoxyphenyl)propanamide is COc1cc(NC(=O)CCc2coc(C)n2)cc(OC)c1OC.
What is the InChIKey of 3-(2-methyl-1,3-oxazol-4-yl)-N-(3,4,5-trimethoxyphenyl)propanamide?
The InChIKey is HUQKJNIOGAOUEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O5/c1-10-17-11(9-23-10)5-6-15(19)18-12-7-13(20-2)16(22-4)14(8-12)21-3/h7-9H,5-6H2,1-4H3,(H,18,19).
What are the key properties of 3-(2-methyl-1,3-oxazol-4-yl)-N-(3,4,5-trimethoxyphenyl)propanamide?
3-(2-methyl-1,3-oxazol-4-yl)-N-(3,4,5-trimethoxyphenyl)propanamide has a molecular weight of 320.35 g/mol, XLogP of 2.58, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methyl-1,3-oxazol-4-yl)-N-(3,4,5-trimethoxyphenyl)propanamide is sourced from PubChem (CID 110679342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).