N-[2-[(2-phenoxyacetyl)amino]ethyl]-2-(2-phenoxyethoxy)acetamide

C20H24N2O5 — CID 47045190

IUPACN-[2-[(2-phenoxyacetyl)amino]ethyl]-2-(2-phenoxyethoxy)acetamide
SMILESO=C(COCCOc1ccccc1)NCCNC(=O)COc1ccccc1
InChIInChI=1S/C20H24N2O5/c23-19(15-25-13-14-26-17-7-3-1-4-8-17)21-11-12-22-20(24)16-27-18-9-5-2-6-10-18/h1-10H,11-16H2,(H,21,23)(H,22,24)
InChIKeyKLTRERIKOAGSIZ-UHFFFAOYSA-N
MW372.42 g/mol
LogP1.39
Rot. Bonds12

About N-[2-[(2-phenoxyacetyl)amino]ethyl]-2-(2-phenoxyethoxy)acetamide

N-[2-[(2-phenoxyacetyl)amino]ethyl]-2-(2-phenoxyethoxy)acetamide (PubChem CID 47045190) has the molecular formula C20H24N2O5 and a molecular weight of 372.42 g/mol. Its IUPAC name is N-[2-[(2-phenoxyacetyl)amino]ethyl]-2-(2-phenoxyethoxy)acetamide.

Molecular Properties

Compound NameN-[2-[(2-phenoxyacetyl)amino]ethyl]-2-(2-phenoxyethoxy)acetamide
PubChem CID47045190
Molecular FormulaC20H24N2O5
Molecular Weight372.42 g/mol
Exact Mass372.17
IUPAC NameN-[2-[(2-phenoxyacetyl)amino]ethyl]-2-(2-phenoxyethoxy)acetamide
SMILESO=C(COCCOc1ccccc1)NCCNC(=O)COc1ccccc1
InChIInChI=1S/C20H24N2O5/c23-19(15-25-13-14-26-17-7-3-1-4-8-17)21-11-12-22-20(24)16-27-18-9-5-2-6-10-18/h1-10H,11-16H2,(H,21,23)(H,22,24)
InChIKeyKLTRERIKOAGSIZ-UHFFFAOYSA-N
XLogP1.39
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds12
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.42
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(2-hydroxyethyl)-2-(2-phenoxyethoxy)acetamide
CID 78883192
N-[2-(methanesulfonamido)ethyl]-2-(2-phenoxyethoxy)acetamide
CID 47034582
N-[2-(4-aminophenyl)ethyl]-2-(2-phenoxyethoxy)acetamide
CID 119547548
2-(4-bromophenoxy)-N-(3-phenoxypropyl)acetamide
CID 9245994
2-(4-methoxyphenoxy)-N-(2-phenoxyethyl)acetamide
CID 2265793
2-[2-oxo-2-(2-phenoxyethylamino)ethoxy]acetate
CID 7322054
N-[2-(4-methoxyphenoxy)ethyl]-2-phenoxyacetamide
CID 17468348
N-(6-bromohexyl)-2-phenoxyacetamide
CID 114008509
N-[2-(benzylamino)ethyl]-2-phenoxyacetamide
CID 12876184
N-[2-(3,5-dimethylphenoxy)ethyl]-2-phenoxyacetamide
CID 19173987
2-[(2-phenoxyacetyl)amino]ethyl 2-phenylacetate
CID 101151355
4-bromo-N-[2-[(2-phenoxyacetyl)amino]ethyl]benzamide
CID 38611489

Frequently Asked Questions

What is the IUPAC name of N-[2-[(2-phenoxyacetyl)amino]ethyl]-2-(2-phenoxyethoxy)acetamide?
The IUPAC name of N-[2-[(2-phenoxyacetyl)amino]ethyl]-2-(2-phenoxyethoxy)acetamide (CID 47045190) is N-[2-[(2-phenoxyacetyl)amino]ethyl]-2-(2-phenoxyethoxy)acetamide.
What is the SMILES notation for N-[2-[(2-phenoxyacetyl)amino]ethyl]-2-(2-phenoxyethoxy)acetamide?
The canonical SMILES for N-[2-[(2-phenoxyacetyl)amino]ethyl]-2-(2-phenoxyethoxy)acetamide is O=C(COCCOc1ccccc1)NCCNC(=O)COc1ccccc1.
What is the InChIKey of N-[2-[(2-phenoxyacetyl)amino]ethyl]-2-(2-phenoxyethoxy)acetamide?
The InChIKey is KLTRERIKOAGSIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O5/c23-19(15-25-13-14-26-17-7-3-1-4-8-17)21-11-12-22-20(24)16-27-18-9-5-2-6-10-18/h1-10H,11-16H2,(H,21,23)(H,22,24).
What are the key properties of N-[2-[(2-phenoxyacetyl)amino]ethyl]-2-(2-phenoxyethoxy)acetamide?
N-[2-[(2-phenoxyacetyl)amino]ethyl]-2-(2-phenoxyethoxy)acetamide has a molecular weight of 372.42 g/mol, XLogP of 1.39, 12 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2-phenoxyacetyl)amino]ethyl]-2-(2-phenoxyethoxy)acetamide is sourced from PubChem (CID 47045190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).