N-(2-aminooxyethyl)-2-(4-fluorophenyl)acetamide

C10H13FN2O2 — CID 39243053

IUPACN-(2-aminooxyethyl)-2-(4-fluorophenyl)acetamide
SMILESNOCCNC(=O)Cc1ccc(F)cc1
InChIInChI=1S/C10H13FN2O2/c11-9-3-1-8(2-4-9)7-10(14)13-5-6-15-12/h1-4H,5-7,12H2,(H,13,14)
InChIKeyJGHIHJIZFKGQCL-UHFFFAOYSA-N
MW212.22 g/mol
LogP0.37
Rot. Bonds5

About N-(2-aminooxyethyl)-2-(4-fluorophenyl)acetamide

N-(2-aminooxyethyl)-2-(4-fluorophenyl)acetamide (PubChem CID 39243053) has the molecular formula C10H13FN2O2 and a molecular weight of 212.22 g/mol. Its IUPAC name is N-(2-aminooxyethyl)-2-(4-fluorophenyl)acetamide.

Molecular Properties

Compound NameN-(2-aminooxyethyl)-2-(4-fluorophenyl)acetamide
PubChem CID39243053
Molecular FormulaC10H13FN2O2
Molecular Weight212.22 g/mol
Exact Mass212.10
IUPAC NameN-(2-aminooxyethyl)-2-(4-fluorophenyl)acetamide
SMILESNOCCNC(=O)Cc1ccc(F)cc1
InChIInChI=1S/C10H13FN2O2/c11-9-3-1-8(2-4-9)7-10(14)13-5-6-15-12/h1-4H,5-7,12H2,(H,13,14)
InChIKeyJGHIHJIZFKGQCL-UHFFFAOYSA-N
XLogP0.37
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.22
LogP ≤ 50.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2-aminooxyethyl)-4-fluorobenzamide
CID 39239976
2-[[2-(4-fluorophenyl)acetyl]amino]ethylcarbamic acid
CID 69253351
N-(3-amino-3-sulfanylidenepropyl)-2-(4-fluorophenyl)acetamide
CID 62666877
N-[2-[[2-(4-fluorophenyl)acetyl]amino]ethyl]-2-(4-methoxyphenyl)acetamide
CID 108538633
2-(4-fluorophenyl)-N-[4-(4-fluorophenyl)butyl]acetamide
CID 110288734
tert-butyl N-[2-[[2-(4-fluorophenyl)acetyl]amino]ethyl]carbamate
CID 71089085
3-(4-fluorophenyl)-N-(2-methoxyethyl)propanamide
CID 70870353
N-[2-(4-chloro-3,5-dimethylphenoxy)ethyl]-2-(4-fluorophenyl)acetamide
CID 113103060
N-[2-(4-chlorophenyl)ethyl]-2-(4-fluorophenyl)acetamide
CID 26516329
2-(4-bromophenyl)-N-[4-(4-fluorophenoxy)butyl]acetamide
CID 42572295
N-[2-(2,4-difluorophenyl)ethyl]-2-(4-fluorophenyl)acetamide
CID 110789003
6-[[2-(4-fluorophenyl)acetyl]amino]hexanoic acid
CID 16793042

Frequently Asked Questions

What is the IUPAC name of N-(2-aminooxyethyl)-2-(4-fluorophenyl)acetamide?
The IUPAC name of N-(2-aminooxyethyl)-2-(4-fluorophenyl)acetamide (CID 39243053) is N-(2-aminooxyethyl)-2-(4-fluorophenyl)acetamide.
What is the SMILES notation for N-(2-aminooxyethyl)-2-(4-fluorophenyl)acetamide?
The canonical SMILES for N-(2-aminooxyethyl)-2-(4-fluorophenyl)acetamide is NOCCNC(=O)Cc1ccc(F)cc1.
What is the InChIKey of N-(2-aminooxyethyl)-2-(4-fluorophenyl)acetamide?
The InChIKey is JGHIHJIZFKGQCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FN2O2/c11-9-3-1-8(2-4-9)7-10(14)13-5-6-15-12/h1-4H,5-7,12H2,(H,13,14).
What are the key properties of N-(2-aminooxyethyl)-2-(4-fluorophenyl)acetamide?
N-(2-aminooxyethyl)-2-(4-fluorophenyl)acetamide has a molecular weight of 212.22 g/mol, XLogP of 0.37, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminooxyethyl)-2-(4-fluorophenyl)acetamide is sourced from PubChem (CID 39243053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).