N-[4-(3,4-dimethoxyphenyl)-1,2-oxazol-5-yl]-2-(4-methylphenoxy)acetamide

C20H20N2O5 — CID 110402676

IUPACN-[4-(3,4-dimethoxyphenyl)-1,2-oxazol-5-yl]-2-(4-methylphenoxy)acetamide
SMILESCOc1ccc(-c2cnoc2NC(=O)COc2ccc(C)cc2)cc1OC
InChIInChI=1S/C20H20N2O5/c1-13-4-7-15(8-5-13)26-12-19(23)22-20-16(11-21-27-20)14-6-9-17(24-2)18(10-14)25-3/h4-11H,12H2,1-3H3,(H,22,23)
InChIKeyVECQZCDMDFHLGE-UHFFFAOYSA-N
MW368.39 g/mol
LogP3.68
Rot. Bonds7

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

N-[4-(3,4-dimethoxyphenyl)-1,2-oxazol-5-yl]-2-(4-methylphenoxy)acetamide (PubChem CID 110402676) has the molecular formula C20H20N2O5 and a molecular weight of 368.39 g/mol. Its IUPAC name is N-[4-(3,4-dimethoxyphenyl)-1,2-oxazol-5-yl]-2-(4-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-[4-(3,4-dimethoxyphenyl)-1,2-oxazol-5-yl]-2-(4-methylphenoxy)acetamide
PubChem CID110402676
Molecular FormulaC20H20N2O5
Molecular Weight368.39 g/mol
Exact Mass368.14
IUPAC NameN-[4-(3,4-dimethoxyphenyl)-1,2-oxazol-5-yl]-2-(4-methylphenoxy)acetamide
SMILESCOc1ccc(-c2cnoc2NC(=O)COc2ccc(C)cc2)cc1OC
InChIInChI=1S/C20H20N2O5/c1-13-4-7-15(8-5-13)26-12-19(23)22-20-16(11-21-27-20)14-6-9-17(24-2)18(10-14)25-3/h4-11H,12H2,1-3H3,(H,22,23)
InChIKeyVECQZCDMDFHLGE-UHFFFAOYSA-N
XLogP3.68
TPSA82.82 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.39
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(4-chlorophenoxy)-N-[4-(3,4-dimethoxyphenyl)-1,2-oxazol-5-yl]acetamide
CID 110402661
2-(2-methoxyphenoxy)-N-[4-(4-methoxyphenyl)-1,2-oxazol-5-yl]acetamide
CID 110402410
3,4-dimethoxy-N-[4-(4-methylphenyl)-1,2-oxazol-5-yl]benzamide
CID 110402230
N-[2-(3,4-dimethoxyphenyl)propan-2-yl]-2-(4-methylphenoxy)acetamide
CID 113091527
3-(2-methoxyphenyl)-N-[4-(4-methoxyphenyl)-1,2-oxazol-5-yl]propanamide
CID 110402430
N-[6-(2,5-dimethoxyanilino)pyridazin-3-yl]-2-(4-methylphenoxy)acetamide
CID 113048769
benzene;bis(2-(4-chlorophenoxy)-N-[4-(3,4-dimethoxyphenyl)-1,2,5-oxadiazol-3-yl]acetamide)
CID 175653131
methyl 4,5-dimethoxy-2-[[2-(4-methylphenoxy)acetyl]amino]benzoate
CID 8801664
N-[bis(3,4-dimethoxyphenyl)methyl]-2-(4-methylphenoxy)acetamide;hydrochloride
CID 18774569
N-[4-(4-methoxyphenyl)-1,2-oxazol-5-yl]-3-methylbenzamide
CID 110402364
N-(4-chloro-2,5-dimethoxyphenyl)-2-[4-(4-methylphenyl)phenoxy]acetamide
CID 1184723
N-[4-(4-methoxy-3-methylphenyl)-1,2,5-oxadiazol-3-yl]-2-(4-methoxyphenoxy)acetamide
CID 17013562

Frequently Asked Questions

What is the IUPAC name of N-[4-(3,4-dimethoxyphenyl)-1,2-oxazol-5-yl]-2-(4-methylphenoxy)acetamide?
The IUPAC name of N-[4-(3,4-dimethoxyphenyl)-1,2-oxazol-5-yl]-2-(4-methylphenoxy)acetamide (CID 110402676) is N-[4-(3,4-dimethoxyphenyl)-1,2-oxazol-5-yl]-2-(4-methylphenoxy)acetamide.
What is the SMILES notation for N-[4-(3,4-dimethoxyphenyl)-1,2-oxazol-5-yl]-2-(4-methylphenoxy)acetamide?
The canonical SMILES for N-[4-(3,4-dimethoxyphenyl)-1,2-oxazol-5-yl]-2-(4-methylphenoxy)acetamide is COc1ccc(-c2cnoc2NC(=O)COc2ccc(C)cc2)cc1OC.
What is the InChIKey of N-[4-(3,4-dimethoxyphenyl)-1,2-oxazol-5-yl]-2-(4-methylphenoxy)acetamide?
The InChIKey is VECQZCDMDFHLGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O5/c1-13-4-7-15(8-5-13)26-12-19(23)22-20-16(11-21-27-20)14-6-9-17(24-2)18(10-14)25-3/h4-11H,12H2,1-3H3,(H,22,23).
What are the key properties of N-[4-(3,4-dimethoxyphenyl)-1,2-oxazol-5-yl]-2-(4-methylphenoxy)acetamide?
N-[4-(3,4-dimethoxyphenyl)-1,2-oxazol-5-yl]-2-(4-methylphenoxy)acetamide has a molecular weight of 368.39 g/mol, XLogP of 3.68, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3,4-dimethoxyphenyl)-1,2-oxazol-5-yl]-2-(4-methylphenoxy)acetamide is sourced from PubChem (CID 110402676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).