N-[[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]methyl]hydroxylamine

C12H17FN2O2 — CID 117353428

IUPACN-[[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]methyl]hydroxylamine
SMILESONCc1ccc(CN2CCOCC2)c(F)c1
InChIInChI=1S/C12H17FN2O2/c13-12-7-10(8-14-16)1-2-11(12)9-15-3-5-17-6-4-15/h1-2,7,14,16H,3-6,8-9H2
InChIKeyZUTPQVDPYKULEB-UHFFFAOYSA-N
MW240.28 g/mol
LogP1.14
Rot. Bonds4

About N-[[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]methyl]hydroxylamine

N-[[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]methyl]hydroxylamine (PubChem CID 117353428) has the molecular formula C12H17FN2O2 and a molecular weight of 240.28 g/mol. Its IUPAC name is N-[[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]methyl]hydroxylamine.

Molecular Properties

Compound NameN-[[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]methyl]hydroxylamine
PubChem CID117353428
Molecular FormulaC12H17FN2O2
Molecular Weight240.28 g/mol
Exact Mass240.13
IUPAC NameN-[[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]methyl]hydroxylamine
SMILESONCc1ccc(CN2CCOCC2)c(F)c1
InChIInChI=1S/C12H17FN2O2/c13-12-7-10(8-14-16)1-2-11(12)9-15-3-5-17-6-4-15/h1-2,7,14,16H,3-6,8-9H2
InChIKeyZUTPQVDPYKULEB-UHFFFAOYSA-N
XLogP1.14
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.28
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-[[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]methyl]hydroxylamine 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

3-Morpholin-4-ylmethyl-benzylamine
CID 6484182
3-(2,4-difluorophenyl)-N-methyl-3-morpholin-4-ylpropan-1-amine
CID 54765676
(4-Benzylmorpholin-2-yl)methanamine
CID 2776360
2-(4-Fluorophenyl)-2-(morpholin-4-yl)ethan-1-amine
CID 4352885
2-(Morpholin-4-ylmethyl)benzeneboronic acid
CID 11736160
N-[(2-Fluorophenyl)methyl]-4-morpholineethanamine
CID 2772118
4,4'-[1,4-Phenylenebis(methylene)]dimorpholine
CID 250932
4-(2-Fluorobenzyl)morpholine
CID 783642
4-(3-Fluorobenzyl)morpholine
CID 783756
[4-(Morpholin-4-ylmethyl)phenyl]methanamine
CID 2795501
Benzyl-(3-morpholin-4-yl-propyl)-amine
CID 206108
4-(2,5-Difluorobenzyl)morpholine
CID 743078

Frequently Asked Questions

What is the IUPAC name of N-[[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]methyl]hydroxylamine?
The IUPAC name of N-[[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]methyl]hydroxylamine (CID 117353428) is N-[[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]methyl]hydroxylamine.
What is the SMILES notation for N-[[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]methyl]hydroxylamine?
The canonical SMILES for N-[[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]methyl]hydroxylamine is ONCc1ccc(CN2CCOCC2)c(F)c1.
What is the InChIKey of N-[[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]methyl]hydroxylamine?
The InChIKey is ZUTPQVDPYKULEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17FN2O2/c13-12-7-10(8-14-16)1-2-11(12)9-15-3-5-17-6-4-15/h1-2,7,14,16H,3-6,8-9H2.
What are the key properties of N-[[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]methyl]hydroxylamine?
N-[[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]methyl]hydroxylamine has a molecular weight of 240.28 g/mol, XLogP of 1.14, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]methyl]hydroxylamine is sourced from PubChem (CID 117353428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).