2-amino-1-(3-chloro-2-fluoro-6-hydroxyphenyl)ethanone

C8H7ClFNO2 — CID 84671891

IUPAC2-amino-1-(3-chloro-2-fluoro-6-hydroxyphenyl)ethanone
SMILESNCC(=O)c1c(O)ccc(Cl)c1F
InChIInChI=1S/C8H7ClFNO2/c9-4-1-2-5(12)7(8(4)10)6(13)3-11/h1-2,12H,3,11H2
InChIKeyUODDLCMMVCBGFU-UHFFFAOYSA-N
MW203.60 g/mol
LogP1.33
Rot. Bonds2

About 2-amino-1-(3-chloro-2-fluoro-6-hydroxyphenyl)ethanone

2-amino-1-(3-chloro-2-fluoro-6-hydroxyphenyl)ethanone (PubChem CID 84671891) has the molecular formula C8H7ClFNO2 and a molecular weight of 203.60 g/mol. Its IUPAC name is 2-amino-1-(3-chloro-2-fluoro-6-hydroxyphenyl)ethanone.

Molecular Properties

Compound Name2-amino-1-(3-chloro-2-fluoro-6-hydroxyphenyl)ethanone
PubChem CID84671891
Molecular FormulaC8H7ClFNO2
Molecular Weight203.60 g/mol
Exact Mass203.01
IUPAC Name2-amino-1-(3-chloro-2-fluoro-6-hydroxyphenyl)ethanone
SMILESNCC(=O)c1c(O)ccc(Cl)c1F
InChIInChI=1S/C8H7ClFNO2/c9-4-1-2-5(12)7(8(4)10)6(13)3-11/h1-2,12H,3,11H2
InChIKeyUODDLCMMVCBGFU-UHFFFAOYSA-N
XLogP1.33
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.60
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-amino-1-(3-chloro-2-fluoro-6-hydroxyphenyl)ethanone 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

5-Chloro-2-hydroxybenzamide
CID 348094
3-Chloro-6-hydroxyacetophenone
CID 74061
1-(5-Chloro-4-fluoro-2-hydroxyphenyl)ethanone
CID 16221436
1-(5-Chloro-2-hydroxyphenyl)-2,2,2-trifluoroethanone
CID 71695286
2-Amino-1-(2-hydroxyphenyl)ethan-1-one
CID 13290576
2-(Tert-butylamino)-1-(5-chloro-2-hydroxyphenyl)propan-1-one
CID 129818881
(E)-1-(5-chloro-2-hydroxyphenyl)-3-(4-fluorophenyl)prop-2-en-1-one
CID 5736188
1-(5-Chloro-2-hydroxyphenyl)-3-(4-fluorophenyl)prop-2-en-1-one
CID 2926703
1-(3-Chloro-2-fluoro-6-hydroxyphenyl)propan-1-one
CID 17998694
(E)-1-(5-chloro-2-hydroxyphenyl)-4-fluorobut-2-en-1-one
CID 68243071
2-Amino-1-(4-fluoro-2-hydroxyphenyl)ethanone
CID 82597856
1-(5-Chloro-4-fluoro-2-hydroxyphenyl)propan-1-one
CID 82717648

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(3-chloro-2-fluoro-6-hydroxyphenyl)ethanone?
The IUPAC name of 2-amino-1-(3-chloro-2-fluoro-6-hydroxyphenyl)ethanone (CID 84671891) is 2-amino-1-(3-chloro-2-fluoro-6-hydroxyphenyl)ethanone.
What is the SMILES notation for 2-amino-1-(3-chloro-2-fluoro-6-hydroxyphenyl)ethanone?
The canonical SMILES for 2-amino-1-(3-chloro-2-fluoro-6-hydroxyphenyl)ethanone is NCC(=O)c1c(O)ccc(Cl)c1F.
What is the InChIKey of 2-amino-1-(3-chloro-2-fluoro-6-hydroxyphenyl)ethanone?
The InChIKey is UODDLCMMVCBGFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7ClFNO2/c9-4-1-2-5(12)7(8(4)10)6(13)3-11/h1-2,12H,3,11H2.
What are the key properties of 2-amino-1-(3-chloro-2-fluoro-6-hydroxyphenyl)ethanone?
2-amino-1-(3-chloro-2-fluoro-6-hydroxyphenyl)ethanone has a molecular weight of 203.60 g/mol, XLogP of 1.33, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(3-chloro-2-fluoro-6-hydroxyphenyl)ethanone is sourced from PubChem (CID 84671891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).