2-(ethylamino)-1-(2-fluorophenyl)-2-methylpropan-1-one

C12H16FNO — CID 116566057

IUPAC2-(ethylamino)-1-(2-fluorophenyl)-2-methylpropan-1-one
SMILESCCNC(C)(C)C(=O)c1ccccc1F
InChIInChI=1S/C12H16FNO/c1-4-14-12(2,3)11(15)9-7-5-6-8-10(9)13/h5-8,14H,4H2,1-3H3
InChIKeyVBUKVLNYKANGQG-UHFFFAOYSA-N
MW209.26 g/mol
LogP2.40
Rot. Bonds4

About 2-(ethylamino)-1-(2-fluorophenyl)-2-methylpropan-1-one

2-(ethylamino)-1-(2-fluorophenyl)-2-methylpropan-1-one (PubChem CID 116566057) has the molecular formula C12H16FNO and a molecular weight of 209.26 g/mol. Its IUPAC name is 2-(ethylamino)-1-(2-fluorophenyl)-2-methylpropan-1-one.

Molecular Properties

Compound Name2-(ethylamino)-1-(2-fluorophenyl)-2-methylpropan-1-one
PubChem CID116566057
Molecular FormulaC12H16FNO
Molecular Weight209.26 g/mol
Exact Mass209.12
IUPAC Name2-(ethylamino)-1-(2-fluorophenyl)-2-methylpropan-1-one
SMILESCCNC(C)(C)C(=O)c1ccccc1F
InChIInChI=1S/C12H16FNO/c1-4-14-12(2,3)11(15)9-7-5-6-8-10(9)13/h5-8,14H,4H2,1-3H3
InChIKeyVBUKVLNYKANGQG-UHFFFAOYSA-N
XLogP2.40
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.26
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-chlorophenyl)-2-(ethylamino)-2-methylpropan-1-one
CID 97356118
1-(2-fluorophenyl)-2,2-dimethylbutan-1-one
CID 24724047
2-(ethylamino)-1-(4-fluorophenyl)-2-methylpropan-1-one
CID 116566054
2,2-difluoro-1-(2-fluorophenyl)butan-1-one
CID 140875241
2-amino-3,3,3-trifluoro-1-(2-fluorophenyl)-2-methylpropan-1-one
CID 116592956
1-(2-chloro-3-fluorophenyl)-3-(ethylamino)-3-methylbutan-2-one
CID 116566201
2-bromo-1-(2-fluorophenyl)-2-methylsulfonylbutan-1-one
CID 102549912
N-[4-[[1-(ethylamino)-3-methyl-1-oxopentan-3-yl]amino]butan-2-yl]-2-fluorobenzamide
CID 139298102
2-ethyl-1-(2-fluorophenyl)-2-methyl-4-phenylbut-3-yn-1-one
CID 164681278
1-(2-fluorophenyl)pentane-1,3-dione
CID 28896114
3-(ethylamino)-3-methyl-1-phenylbutan-2-one
CID 116565964
(2S)-2-(2,6-difluorophenyl)-2-(ethylamino)propanoic acid
CID 93280142

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-1-(2-fluorophenyl)-2-methylpropan-1-one?
The IUPAC name of 2-(ethylamino)-1-(2-fluorophenyl)-2-methylpropan-1-one (CID 116566057) is 2-(ethylamino)-1-(2-fluorophenyl)-2-methylpropan-1-one.
What is the SMILES notation for 2-(ethylamino)-1-(2-fluorophenyl)-2-methylpropan-1-one?
The canonical SMILES for 2-(ethylamino)-1-(2-fluorophenyl)-2-methylpropan-1-one is CCNC(C)(C)C(=O)c1ccccc1F.
What is the InChIKey of 2-(ethylamino)-1-(2-fluorophenyl)-2-methylpropan-1-one?
The InChIKey is VBUKVLNYKANGQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FNO/c1-4-14-12(2,3)11(15)9-7-5-6-8-10(9)13/h5-8,14H,4H2,1-3H3.
What are the key properties of 2-(ethylamino)-1-(2-fluorophenyl)-2-methylpropan-1-one?
2-(ethylamino)-1-(2-fluorophenyl)-2-methylpropan-1-one has a molecular weight of 209.26 g/mol, XLogP of 2.40, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-1-(2-fluorophenyl)-2-methylpropan-1-one is sourced from PubChem (CID 116566057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).