N-[2-[carbamoyl(hydroxy)amino]ethyl]-2-(4-phenoxyphenoxy)acetamide

C17H19N3O5 — CID 19761862

IUPACN-[2-[carbamoyl(hydroxy)amino]ethyl]-2-(4-phenoxyphenoxy)acetamide
SMILESNC(=O)N(O)CCNC(=O)COc1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C17H19N3O5/c18-17(22)20(23)11-10-19-16(21)12-24-13-6-8-15(9-7-13)25-14-4-2-1-3-5-14/h1-9,23H,10-12H2,(H2,18,22)(H,19,21)
InChIKeyPHYXRGYUWWMJNX-UHFFFAOYSA-N
MW345.36 g/mol
LogP1.74
Rot. Bonds8

About N-[2-[carbamoyl(hydroxy)amino]ethyl]-2-(4-phenoxyphenoxy)acetamide

N-[2-[carbamoyl(hydroxy)amino]ethyl]-2-(4-phenoxyphenoxy)acetamide (PubChem CID 19761862) has the molecular formula C17H19N3O5 and a molecular weight of 345.36 g/mol. Its IUPAC name is N-[2-[carbamoyl(hydroxy)amino]ethyl]-2-(4-phenoxyphenoxy)acetamide.

Molecular Properties

Compound NameN-[2-[carbamoyl(hydroxy)amino]ethyl]-2-(4-phenoxyphenoxy)acetamide
PubChem CID19761862
Molecular FormulaC17H19N3O5
Molecular Weight345.36 g/mol
Exact Mass345.13
IUPAC NameN-[2-[carbamoyl(hydroxy)amino]ethyl]-2-(4-phenoxyphenoxy)acetamide
SMILESNC(=O)N(O)CCNC(=O)COc1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C17H19N3O5/c18-17(22)20(23)11-10-19-16(21)12-24-13-6-8-15(9-7-13)25-14-4-2-1-3-5-14/h1-9,23H,10-12H2,(H2,18,22)(H,19,21)
InChIKeyPHYXRGYUWWMJNX-UHFFFAOYSA-N
XLogP1.74
TPSA114.12 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.36
LogP ≤ 51.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(4-phenoxyphenoxy)acetohydrazide
CID 873173
N-(3-amino-3-sulfanylidenepropyl)-2-phenoxyacetamide
CID 62666698
N-(2-aminoethyl)-2-(4-benzylphenoxy)acetamide
CID 62275392
N-[2-(diethylamino)propyl]-2-(4-phenoxyphenoxy)acetamide
CID 46433016
N-(hydroxymethyl)-2-phenoxyacetamide
CID 12769641
2-(4-phenoxyphenoxy)-N'-phenylacetohydrazide
CID 78835711
N-(2-amino-2-sulfanylideneethyl)-2-phenoxyacetamide
CID 61126897
2-(4-methoxyphenoxy)-N-(2-phenoxyethyl)acetamide
CID 2265793
N-[2-(4-methoxyphenoxy)ethyl]-2-phenoxyacetamide
CID 17468348
N-(3-aminobutyl)-2-[(2-phenoxyacetyl)amino]acetamide
CID 119497991
N-[4-(diethylamino)butyl]-2-phenoxyacetamide
CID 110442217
N-[2-[(2-phenoxyacetyl)amino]ethyl]-2-(2-phenoxyethoxy)acetamide
CID 47045190

Frequently Asked Questions

What is the IUPAC name of N-[2-[carbamoyl(hydroxy)amino]ethyl]-2-(4-phenoxyphenoxy)acetamide?
The IUPAC name of N-[2-[carbamoyl(hydroxy)amino]ethyl]-2-(4-phenoxyphenoxy)acetamide (CID 19761862) is N-[2-[carbamoyl(hydroxy)amino]ethyl]-2-(4-phenoxyphenoxy)acetamide.
What is the SMILES notation for N-[2-[carbamoyl(hydroxy)amino]ethyl]-2-(4-phenoxyphenoxy)acetamide?
The canonical SMILES for N-[2-[carbamoyl(hydroxy)amino]ethyl]-2-(4-phenoxyphenoxy)acetamide is NC(=O)N(O)CCNC(=O)COc1ccc(Oc2ccccc2)cc1.
What is the InChIKey of N-[2-[carbamoyl(hydroxy)amino]ethyl]-2-(4-phenoxyphenoxy)acetamide?
The InChIKey is PHYXRGYUWWMJNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O5/c18-17(22)20(23)11-10-19-16(21)12-24-13-6-8-15(9-7-13)25-14-4-2-1-3-5-14/h1-9,23H,10-12H2,(H2,18,22)(H,19,21).
What are the key properties of N-[2-[carbamoyl(hydroxy)amino]ethyl]-2-(4-phenoxyphenoxy)acetamide?
N-[2-[carbamoyl(hydroxy)amino]ethyl]-2-(4-phenoxyphenoxy)acetamide has a molecular weight of 345.36 g/mol, XLogP of 1.74, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[carbamoyl(hydroxy)amino]ethyl]-2-(4-phenoxyphenoxy)acetamide is sourced from PubChem (CID 19761862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).