2-amino-1-(2-fluorophenyl)ethanone;hydrochloride

C8H9ClFNO — CID 13290663

IUPAC2-amino-1-(2-fluorophenyl)ethanone;hydrochloride
SMILESCl.NCC(=O)c1ccccc1F
InChIInChI=1S/C8H8FNO.ClH/c9-7-4-2-1-3-6(7)8(11)5-10;/h1-4H,5,10H2;1H
InChIKeyGFHFMCRPNVXGFL-UHFFFAOYSA-N
MW189.62 g/mol
LogP1.39
Rot. Bonds2

About 2-amino-1-(2-fluorophenyl)ethanone;hydrochloride

2-amino-1-(2-fluorophenyl)ethanone;hydrochloride (PubChem CID 13290663) has the molecular formula C8H9ClFNO and a molecular weight of 189.62 g/mol. Its IUPAC name is 2-amino-1-(2-fluorophenyl)ethanone;hydrochloride.

Molecular Properties

Compound Name2-amino-1-(2-fluorophenyl)ethanone;hydrochloride
PubChem CID13290663
Molecular FormulaC8H9ClFNO
Molecular Weight189.62 g/mol
Exact Mass189.04
IUPAC Name2-amino-1-(2-fluorophenyl)ethanone;hydrochloride
SMILESCl.NCC(=O)c1ccccc1F
InChIInChI=1S/C8H8FNO.ClH/c9-7-4-2-1-3-6(7)8(11)5-10;/h1-4H,5,10H2;1H
InChIKeyGFHFMCRPNVXGFL-UHFFFAOYSA-N
XLogP1.39
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.62
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-amino-1-(2-fluorophenyl)ethanone;hydrochloride 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 2-amino-1-(2-fluorophenyl)ethanone;hydrochloride?
The IUPAC name of 2-amino-1-(2-fluorophenyl)ethanone;hydrochloride (CID 13290663) is 2-amino-1-(2-fluorophenyl)ethanone;hydrochloride.
What is the SMILES notation for 2-amino-1-(2-fluorophenyl)ethanone;hydrochloride?
The canonical SMILES for 2-amino-1-(2-fluorophenyl)ethanone;hydrochloride is Cl.NCC(=O)c1ccccc1F.
What is the InChIKey of 2-amino-1-(2-fluorophenyl)ethanone;hydrochloride?
The InChIKey is GFHFMCRPNVXGFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8FNO.ClH/c9-7-4-2-1-3-6(7)8(11)5-10;/h1-4H,5,10H2;1H.
What are the key properties of 2-amino-1-(2-fluorophenyl)ethanone;hydrochloride?
2-amino-1-(2-fluorophenyl)ethanone;hydrochloride has a molecular weight of 189.62 g/mol, XLogP of 1.39, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(2-fluorophenyl)ethanone;hydrochloride is sourced from PubChem (CID 13290663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).