1-(2,4-difluorophenyl)-2-(ethylamino)ethanone

C10H11F2NO — CID 82282170

IUPAC1-(2,4-difluorophenyl)-2-(ethylamino)ethanone
SMILESCCNCC(=O)c1ccc(F)cc1F
InChIInChI=1S/C10H11F2NO/c1-2-13-6-10(14)8-4-3-7(11)5-9(8)12/h3-5,13H,2,6H2,1H3
InChIKeyHQWXZFKITXZWLW-UHFFFAOYSA-N
MW199.20 g/mol
LogP1.76
Rot. Bonds4

About 1-(2,4-difluorophenyl)-2-(ethylamino)ethanone

1-(2,4-difluorophenyl)-2-(ethylamino)ethanone (PubChem CID 82282170) has the molecular formula C10H11F2NO and a molecular weight of 199.20 g/mol. Its IUPAC name is 1-(2,4-difluorophenyl)-2-(ethylamino)ethanone.

Molecular Properties

Compound Name1-(2,4-difluorophenyl)-2-(ethylamino)ethanone
PubChem CID82282170
Molecular FormulaC10H11F2NO
Molecular Weight199.20 g/mol
Exact Mass199.08
IUPAC Name1-(2,4-difluorophenyl)-2-(ethylamino)ethanone
SMILESCCNCC(=O)c1ccc(F)cc1F
InChIInChI=1S/C10H11F2NO/c1-2-13-6-10(14)8-4-3-7(11)5-9(8)12/h3-5,13H,2,6H2,1H3
InChIKeyHQWXZFKITXZWLW-UHFFFAOYSA-N
XLogP1.76
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.20
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,4-difluorophenyl)-2-(prop-2-enylamino)ethanone
CID 116589743
2-(ethylamino)-1-(5-fluoro-1H-indol-3-yl)ethanone
CID 82493978
1-(2,4-difluorophenyl)-4-methylpentane-1,3-dione
CID 63319815
2-bromo-1-(2,4-difluorophenyl)ethanone
CID 2774185
1-(2,4-difluorophenyl)dodecan-1-one
CID 65448734
ethyl 4-(2,4-difluorophenyl)-2,4-dioxobutanoate
CID 603034
1-(2,4-difluorophenyl)octane-1,3-dione
CID 43321124
2,4-difluoro-N-pent-1-yn-3-ylbenzamide
CID 103579084
1-(2,4-difluorophenyl)-2-propylsulfinylethanone
CID 64639884
3-(tert-butylamino)-1-(2,4-difluorophenyl)propan-1-one
CID 116557890
1-(2,4-difluorophenyl)-2-(2-ethoxyethoxy)ethanone
CID 43798375
1-(2,4-difluorophenyl)-2-methylbutan-1-one
CID 43160006

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-difluorophenyl)-2-(ethylamino)ethanone?
The IUPAC name of 1-(2,4-difluorophenyl)-2-(ethylamino)ethanone (CID 82282170) is 1-(2,4-difluorophenyl)-2-(ethylamino)ethanone.
What is the SMILES notation for 1-(2,4-difluorophenyl)-2-(ethylamino)ethanone?
The canonical SMILES for 1-(2,4-difluorophenyl)-2-(ethylamino)ethanone is CCNCC(=O)c1ccc(F)cc1F.
What is the InChIKey of 1-(2,4-difluorophenyl)-2-(ethylamino)ethanone?
The InChIKey is HQWXZFKITXZWLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F2NO/c1-2-13-6-10(14)8-4-3-7(11)5-9(8)12/h3-5,13H,2,6H2,1H3.
What are the key properties of 1-(2,4-difluorophenyl)-2-(ethylamino)ethanone?
1-(2,4-difluorophenyl)-2-(ethylamino)ethanone has a molecular weight of 199.20 g/mol, XLogP of 1.76, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-difluorophenyl)-2-(ethylamino)ethanone is sourced from PubChem (CID 82282170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).