[2-[3-(ethylcarbamoyl)anilino]-2-oxoethyl] 2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetate

C17H19N3O6 — CID 9348165

IUPAC[2-[3-(ethylcarbamoyl)anilino]-2-oxoethyl] 2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetate
SMILESCCNC(=O)c1cccc(NC(=O)COC(=O)COc2cc(C)on2)c1
InChIInChI=1S/C17H19N3O6/c1-3-18-17(23)12-5-4-6-13(8-12)19-14(21)9-25-16(22)10-24-15-7-11(2)26-20-15/h4-8H,3,9-10H2,1-2H3,(H,18,23)(H,19,21)
InChIKeyXYDCKPOFGFPHCG-UHFFFAOYSA-N
MW361.35 g/mol
LogP1.29
Rot. Bonds8

About [2-[3-(ethylcarbamoyl)anilino]-2-oxoethyl] 2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetate

[2-[3-(ethylcarbamoyl)anilino]-2-oxoethyl] 2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetate (PubChem CID 9348165) has the molecular formula C17H19N3O6 and a molecular weight of 361.35 g/mol. Its IUPAC name is [2-[3-(ethylcarbamoyl)anilino]-2-oxoethyl] 2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetate.

Molecular Properties

Compound Name[2-[3-(ethylcarbamoyl)anilino]-2-oxoethyl] 2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetate
PubChem CID9348165
Molecular FormulaC17H19N3O6
Molecular Weight361.35 g/mol
Exact Mass361.13
IUPAC Name[2-[3-(ethylcarbamoyl)anilino]-2-oxoethyl] 2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetate
SMILESCCNC(=O)c1cccc(NC(=O)COC(=O)COc2cc(C)on2)c1
InChIInChI=1S/C17H19N3O6/c1-3-18-17(23)12-5-4-6-13(8-12)19-14(21)9-25-16(22)10-24-15-7-11(2)26-20-15/h4-8H,3,9-10H2,1-2H3,(H,18,23)(H,19,21)
InChIKeyXYDCKPOFGFPHCG-UHFFFAOYSA-N
XLogP1.29
TPSA119.76 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.35
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

[2-[3-(ethylcarbamoyl)anilino]-2-oxoethyl] 2-(2-methylphenoxy)acetate
CID 9335752
[2-[3-(ethylcarbamoyl)anilino]-2-oxoethyl] 2-(4-chloro-2-methylphenoxy)acetate
CID 9230877
[2-[3-(ethylcarbamoyl)anilino]-2-oxoethyl] 2-(2-methyl-5-propan-2-ylphenoxy)acetate
CID 8806398
[2-[3-(ethylcarbamoyl)anilino]-2-oxoethyl] benzoate
CID 17393277
[2-[3-(ethylcarbamoyl)anilino]-2-oxoethyl] 2-(3,4-dimethylphenyl)acetate
CID 8847291
[2-[3-(ethylcarbamoyl)anilino]-2-oxoethyl] 3-methylbenzoate
CID 27893664
1-O-ethyl 4-O-[2-[3-(ethylcarbamoyl)anilino]-2-oxoethyl] (E)-but-2-enedioate
CID 9015321
[2-[3-(ethylcarbamoyl)anilino]-2-oxoethyl] 2-cyclopentylacetate
CID 9202924
[2-[3-(ethylcarbamoyl)anilino]-2-oxoethyl] 3-bromobenzoate
CID 9017331
[2-[3-(ethylcarbamoyl)anilino]-2-oxoethyl] 2-(1,3,5-trimethylpyrazol-4-yl)acetate
CID 37238561
N-ethyl-3-[(2-naphthalen-2-yloxyacetyl)amino]benzamide
CID 17230651
3-[[2-(4-ethoxyanilino)acetyl]amino]-N-ethylbenzamide
CID 54811015

Frequently Asked Questions

What is the IUPAC name of [2-[3-(ethylcarbamoyl)anilino]-2-oxoethyl] 2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetate?
The IUPAC name of [2-[3-(ethylcarbamoyl)anilino]-2-oxoethyl] 2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetate (CID 9348165) is [2-[3-(ethylcarbamoyl)anilino]-2-oxoethyl] 2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetate.
What is the SMILES notation for [2-[3-(ethylcarbamoyl)anilino]-2-oxoethyl] 2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetate?
The canonical SMILES for [2-[3-(ethylcarbamoyl)anilino]-2-oxoethyl] 2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetate is CCNC(=O)c1cccc(NC(=O)COC(=O)COc2cc(C)on2)c1.
What is the InChIKey of [2-[3-(ethylcarbamoyl)anilino]-2-oxoethyl] 2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetate?
The InChIKey is XYDCKPOFGFPHCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O6/c1-3-18-17(23)12-5-4-6-13(8-12)19-14(21)9-25-16(22)10-24-15-7-11(2)26-20-15/h4-8H,3,9-10H2,1-2H3,(H,18,23)(H,19,21).
What are the key properties of [2-[3-(ethylcarbamoyl)anilino]-2-oxoethyl] 2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetate?
[2-[3-(ethylcarbamoyl)anilino]-2-oxoethyl] 2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetate has a molecular weight of 361.35 g/mol, XLogP of 1.29, 8 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[3-(ethylcarbamoyl)anilino]-2-oxoethyl] 2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetate is sourced from PubChem (CID 9348165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).