methyl 2-[4-[[2-(3-carbamoylphenoxy)acetyl]amino]phenoxy]acetate

C18H18N2O6 — CID 55911984

IUPACmethyl 2-[4-[[2-(3-carbamoylphenoxy)acetyl]amino]phenoxy]acetate
SMILESCOC(=O)COc1ccc(NC(=O)COc2cccc(C(N)=O)c2)cc1
InChIInChI=1S/C18H18N2O6/c1-24-17(22)11-26-14-7-5-13(6-8-14)20-16(21)10-25-15-4-2-3-12(9-15)18(19)23/h2-9H,10-11H2,1H3,(H2,19,23)(H,20,21)
InChIKeyDLDXEOMHJAHLQK-UHFFFAOYSA-N
MW358.35 g/mol
LogP1.35
Rot. Bonds8

About methyl 2-[4-[[2-(3-carbamoylphenoxy)acetyl]amino]phenoxy]acetate

methyl 2-[4-[[2-(3-carbamoylphenoxy)acetyl]amino]phenoxy]acetate (PubChem CID 55911984) has the molecular formula C18H18N2O6 and a molecular weight of 358.35 g/mol. Its IUPAC name is methyl 2-[4-[[2-(3-carbamoylphenoxy)acetyl]amino]phenoxy]acetate.

Molecular Properties

Compound Namemethyl 2-[4-[[2-(3-carbamoylphenoxy)acetyl]amino]phenoxy]acetate
PubChem CID55911984
Molecular FormulaC18H18N2O6
Molecular Weight358.35 g/mol
Exact Mass358.12
IUPAC Namemethyl 2-[4-[[2-(3-carbamoylphenoxy)acetyl]amino]phenoxy]acetate
SMILESCOC(=O)COc1ccc(NC(=O)COc2cccc(C(N)=O)c2)cc1
InChIInChI=1S/C18H18N2O6/c1-24-17(22)11-26-14-7-5-13(6-8-14)20-16(21)10-25-15-4-2-3-12(9-15)18(19)23/h2-9H,10-11H2,1H3,(H2,19,23)(H,20,21)
InChIKeyDLDXEOMHJAHLQK-UHFFFAOYSA-N
XLogP1.35
TPSA116.95 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.35
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze methyl 2-[4-[[2-(3-carbamoylphenoxy)acetyl]amino]phenoxy]acetate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

methyl 2-[3-[[2-(4-fluorophenoxy)acetyl]amino]phenoxy]acetate
CID 17341883
3-[(2-phenoxyacetyl)amino]benzamide
CID 910367
methyl 2-[4-[2-(4-carbamoylanilino)-2-oxoethoxy]phenyl]acetate
CID 7695222
2-[3-[2-(4-methoxyanilino)-2-oxoethoxy]phenoxy]-N-(4-methoxyphenyl)acetamide
CID 71417144
methyl 2-[4-[[2-(3,5-dimethylphenoxy)acetyl]amino]phenoxy]acetate
CID 2975656
N-(4-acetamidophenyl)-2-(3-acetylphenoxy)acetamide
CID 2627260
3-[2-(4-cyclopentylsulfanylanilino)-2-oxoethoxy]benzamide
CID 55910430
2-(3-acetylphenoxy)-N-(4-methylphenyl)acetamide
CID 2616941
N-(3-carbamothioylphenyl)-2-(4-methoxyphenoxy)acetamide
CID 39158622
N-(4-bromophenyl)-2-(3-carbamothioylphenoxy)acetamide
CID 28512642
[2-(4-bromoanilino)-2-oxoethyl] 2-(3-acetylphenoxy)acetate
CID 8526262
[2-(3-methoxyanilino)-2-oxoethyl] 2-(4-methoxyphenoxy)acetate
CID 2590569

Frequently Asked Questions

What is the IUPAC name of methyl 2-[4-[[2-(3-carbamoylphenoxy)acetyl]amino]phenoxy]acetate?
The IUPAC name of methyl 2-[4-[[2-(3-carbamoylphenoxy)acetyl]amino]phenoxy]acetate (CID 55911984) is methyl 2-[4-[[2-(3-carbamoylphenoxy)acetyl]amino]phenoxy]acetate.
What is the SMILES notation for methyl 2-[4-[[2-(3-carbamoylphenoxy)acetyl]amino]phenoxy]acetate?
The canonical SMILES for methyl 2-[4-[[2-(3-carbamoylphenoxy)acetyl]amino]phenoxy]acetate is COC(=O)COc1ccc(NC(=O)COc2cccc(C(N)=O)c2)cc1.
What is the InChIKey of methyl 2-[4-[[2-(3-carbamoylphenoxy)acetyl]amino]phenoxy]acetate?
The InChIKey is DLDXEOMHJAHLQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O6/c1-24-17(22)11-26-14-7-5-13(6-8-14)20-16(21)10-25-15-4-2-3-12(9-15)18(19)23/h2-9H,10-11H2,1H3,(H2,19,23)(H,20,21).
What are the key properties of methyl 2-[4-[[2-(3-carbamoylphenoxy)acetyl]amino]phenoxy]acetate?
methyl 2-[4-[[2-(3-carbamoylphenoxy)acetyl]amino]phenoxy]acetate has a molecular weight of 358.35 g/mol, XLogP of 1.35, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[4-[[2-(3-carbamoylphenoxy)acetyl]amino]phenoxy]acetate is sourced from PubChem (CID 55911984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).