N-[(1R)-1-(2,4-difluorophenyl)ethyl]hydroxylamine

C8H9F2NO — CID 130054510

IUPACN-[(1R)-1-(2,4-difluorophenyl)ethyl]hydroxylamine
SMILESC[C@@H](NO)c1ccc(F)cc1F
InChIInChI=1S/C8H9F2NO/c1-5(11-12)7-3-2-6(9)4-8(7)10/h2-5,11-12H,1H3/t5-/m1/s1
InChIKeyURKQZJOXFQYNIL-RXMQYKEDSA-N
MW173.16 g/mol
LogP2.00
Rot. Bonds2

About N-[(1R)-1-(2,4-difluorophenyl)ethyl]hydroxylamine

N-[(1R)-1-(2,4-difluorophenyl)ethyl]hydroxylamine (PubChem CID 130054510) has the molecular formula C8H9F2NO and a molecular weight of 173.16 g/mol. Its IUPAC name is N-[(1R)-1-(2,4-difluorophenyl)ethyl]hydroxylamine.

Molecular Properties

Compound NameN-[(1R)-1-(2,4-difluorophenyl)ethyl]hydroxylamine
PubChem CID130054510
Molecular FormulaC8H9F2NO
Molecular Weight173.16 g/mol
Exact Mass173.07
IUPAC NameN-[(1R)-1-(2,4-difluorophenyl)ethyl]hydroxylamine
SMILESC[C@@H](NO)c1ccc(F)cc1F
InChIInChI=1S/C8H9F2NO/c1-5(11-12)7-3-2-6(9)4-8(7)10/h2-5,11-12H,1H3/t5-/m1/s1
InChIKeyURKQZJOXFQYNIL-RXMQYKEDSA-N
XLogP2.00
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.16
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-[(1R)-1-(2,4-difluorophenyl)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

Related Compounds

Amphetamine
CID 3007
Dextroamphetamine
CID 5826
1-Phenethylamine
CID 7408
(-)-Amphetamine
CID 32893
4-Fluorobenzylamine
CID 67326
1-Phenethylamine, (-)-
CID 75818
1-Phenethylamine, (+)-
CID 643189
Mofegiline
CID 6437850
(+-)-p-Fluoroamphetamine
CID 9986
1-(4-Methylphenyl)ethylamine
CID 577386
2-(2-Fluorophenyl)ethylamine
CID 643357
4-Fluoroamphetamine hydrochloride
CID 120675

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-(2,4-difluorophenyl)ethyl]hydroxylamine?
The IUPAC name of N-[(1R)-1-(2,4-difluorophenyl)ethyl]hydroxylamine (CID 130054510) is N-[(1R)-1-(2,4-difluorophenyl)ethyl]hydroxylamine.
What is the SMILES notation for N-[(1R)-1-(2,4-difluorophenyl)ethyl]hydroxylamine?
The canonical SMILES for N-[(1R)-1-(2,4-difluorophenyl)ethyl]hydroxylamine is C[C@@H](NO)c1ccc(F)cc1F.
What is the InChIKey of N-[(1R)-1-(2,4-difluorophenyl)ethyl]hydroxylamine?
The InChIKey is URKQZJOXFQYNIL-RXMQYKEDSA-N. The full InChI is InChI=1S/C8H9F2NO/c1-5(11-12)7-3-2-6(9)4-8(7)10/h2-5,11-12H,1H3/t5-/m1/s1.
What are the key properties of N-[(1R)-1-(2,4-difluorophenyl)ethyl]hydroxylamine?
N-[(1R)-1-(2,4-difluorophenyl)ethyl]hydroxylamine has a molecular weight of 173.16 g/mol, XLogP of 2.00, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-(2,4-difluorophenyl)ethyl]hydroxylamine is sourced from PubChem (CID 130054510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).