methyl 2-[3-[(2-ethoxybenzoyl)amino]phenoxy]acetate

C18H19NO5 — CID 46416869

IUPACmethyl 2-[3-[(2-ethoxybenzoyl)amino]phenoxy]acetate
SMILESCCOc1ccccc1C(=O)Nc1cccc(OCC(=O)OC)c1
InChIInChI=1S/C18H19NO5/c1-3-23-16-10-5-4-9-15(16)18(21)19-13-7-6-8-14(11-13)24-12-17(20)22-2/h4-11H,3,12H2,1-2H3,(H,19,21)
InChIKeyQDUYETXMLCVQLJ-UHFFFAOYSA-N
MW329.35 g/mol
LogP2.89
Rot. Bonds7

About methyl 2-[3-[(2-ethoxybenzoyl)amino]phenoxy]acetate

methyl 2-[3-[(2-ethoxybenzoyl)amino]phenoxy]acetate (PubChem CID 46416869) has the molecular formula C18H19NO5 and a molecular weight of 329.35 g/mol. Its IUPAC name is methyl 2-[3-[(2-ethoxybenzoyl)amino]phenoxy]acetate.

Molecular Properties

Compound Namemethyl 2-[3-[(2-ethoxybenzoyl)amino]phenoxy]acetate
PubChem CID46416869
Molecular FormulaC18H19NO5
Molecular Weight329.35 g/mol
Exact Mass329.13
IUPAC Namemethyl 2-[3-[(2-ethoxybenzoyl)amino]phenoxy]acetate
SMILESCCOc1ccccc1C(=O)Nc1cccc(OCC(=O)OC)c1
InChIInChI=1S/C18H19NO5/c1-3-23-16-10-5-4-9-15(16)18(21)19-13-7-6-8-14(11-13)24-12-17(20)22-2/h4-11H,3,12H2,1-2H3,(H,19,21)
InChIKeyQDUYETXMLCVQLJ-UHFFFAOYSA-N
XLogP2.89
TPSA73.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.35
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-ethoxy-N-(3-methoxyphenyl)benzamide
CID 760215
2-[[3-(2-methoxy-2-oxoethoxy)phenyl]carbamoyl]benzoic acid
CID 17359941
N-(3-acetylphenyl)-2-ethoxybenzamide
CID 773754
ethyl 2-[3-[(2-fluorobenzoyl)amino]phenoxy]acetate
CID 39269783
N-[3-(2-methoxyethoxy)phenyl]-2-(2-phenoxyethoxy)benzamide
CID 17169883
N-(3-carbamoylphenyl)-2-ethoxybenzamide
CID 25049798
2-ethoxy-N-[4-[(2-ethoxybenzoyl)amino]phenyl]benzamide
CID 1011206
2-[(3-ethoxyphenyl)carbamoyl]benzoic acid
CID 17098079
2-(2-ethoxyethoxy)-N-(3-methoxyphenyl)benzamide
CID 17122713
2-ethoxy-N-[(3-propan-2-yloxyphenyl)carbamothioyl]benzamide
CID 17154886
2-ethoxy-N-(4-methoxyphenyl)benzamide
CID 5019237
2-ethoxy-N-[3-(1-hydroxyethyl)phenyl]benzamide
CID 43508405

Frequently Asked Questions

What is the IUPAC name of methyl 2-[3-[(2-ethoxybenzoyl)amino]phenoxy]acetate?
The IUPAC name of methyl 2-[3-[(2-ethoxybenzoyl)amino]phenoxy]acetate (CID 46416869) is methyl 2-[3-[(2-ethoxybenzoyl)amino]phenoxy]acetate.
What is the SMILES notation for methyl 2-[3-[(2-ethoxybenzoyl)amino]phenoxy]acetate?
The canonical SMILES for methyl 2-[3-[(2-ethoxybenzoyl)amino]phenoxy]acetate is CCOc1ccccc1C(=O)Nc1cccc(OCC(=O)OC)c1.
What is the InChIKey of methyl 2-[3-[(2-ethoxybenzoyl)amino]phenoxy]acetate?
The InChIKey is QDUYETXMLCVQLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO5/c1-3-23-16-10-5-4-9-15(16)18(21)19-13-7-6-8-14(11-13)24-12-17(20)22-2/h4-11H,3,12H2,1-2H3,(H,19,21).
What are the key properties of methyl 2-[3-[(2-ethoxybenzoyl)amino]phenoxy]acetate?
methyl 2-[3-[(2-ethoxybenzoyl)amino]phenoxy]acetate has a molecular weight of 329.35 g/mol, XLogP of 2.89, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[3-[(2-ethoxybenzoyl)amino]phenoxy]acetate is sourced from PubChem (CID 46416869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).