O-[2-(3-fluoro-4-morpholin-4-ylphenyl)ethyl]hydroxylamine

C12H17FN2O2 — CID 117353426

IUPACO-[2-(3-fluoro-4-morpholin-4-ylphenyl)ethyl]hydroxylamine
SMILESNOCCc1ccc(N2CCOCC2)c(F)c1
InChIInChI=1S/C12H17FN2O2/c13-11-9-10(3-6-17-14)1-2-12(11)15-4-7-16-8-5-15/h1-2,9H,3-8,14H2
InChIKeyNWHGXGZVLQUUPB-UHFFFAOYSA-N
MW240.28 g/mol
LogP1.10
Rot. Bonds4

About O-[2-(3-fluoro-4-morpholin-4-ylphenyl)ethyl]hydroxylamine

O-[2-(3-fluoro-4-morpholin-4-ylphenyl)ethyl]hydroxylamine (PubChem CID 117353426) has the molecular formula C12H17FN2O2 and a molecular weight of 240.28 g/mol. Its IUPAC name is O-[2-(3-fluoro-4-morpholin-4-ylphenyl)ethyl]hydroxylamine.

Molecular Properties

Compound NameO-[2-(3-fluoro-4-morpholin-4-ylphenyl)ethyl]hydroxylamine
PubChem CID117353426
Molecular FormulaC12H17FN2O2
Molecular Weight240.28 g/mol
Exact Mass240.13
IUPAC NameO-[2-(3-fluoro-4-morpholin-4-ylphenyl)ethyl]hydroxylamine
SMILESNOCCc1ccc(N2CCOCC2)c(F)c1
InChIInChI=1S/C12H17FN2O2/c13-11-9-10(3-6-17-14)1-2-12(11)15-4-7-16-8-5-15/h1-2,9H,3-8,14H2
InChIKeyNWHGXGZVLQUUPB-UHFFFAOYSA-N
XLogP1.10
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.28
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze O-[2-(3-fluoro-4-morpholin-4-ylphenyl)ethyl]hydroxylamine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of O-[2-(3-fluoro-4-morpholin-4-ylphenyl)ethyl]hydroxylamine?
The IUPAC name of O-[2-(3-fluoro-4-morpholin-4-ylphenyl)ethyl]hydroxylamine (CID 117353426) is O-[2-(3-fluoro-4-morpholin-4-ylphenyl)ethyl]hydroxylamine.
What is the SMILES notation for O-[2-(3-fluoro-4-morpholin-4-ylphenyl)ethyl]hydroxylamine?
The canonical SMILES for O-[2-(3-fluoro-4-morpholin-4-ylphenyl)ethyl]hydroxylamine is NOCCc1ccc(N2CCOCC2)c(F)c1.
What is the InChIKey of O-[2-(3-fluoro-4-morpholin-4-ylphenyl)ethyl]hydroxylamine?
The InChIKey is NWHGXGZVLQUUPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17FN2O2/c13-11-9-10(3-6-17-14)1-2-12(11)15-4-7-16-8-5-15/h1-2,9H,3-8,14H2.
What are the key properties of O-[2-(3-fluoro-4-morpholin-4-ylphenyl)ethyl]hydroxylamine?
O-[2-(3-fluoro-4-morpholin-4-ylphenyl)ethyl]hydroxylamine has a molecular weight of 240.28 g/mol, XLogP of 1.10, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for O-[2-(3-fluoro-4-morpholin-4-ylphenyl)ethyl]hydroxylamine is sourced from PubChem (CID 117353426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).