2-(N-ethylanilino)-1-(3-fluorophenyl)ethanone

C16H16FNO — CID 43227492

IUPAC2-(N-ethylanilino)-1-(3-fluorophenyl)ethanone
SMILESCCN(CC(=O)c1cccc(F)c1)c1ccccc1
InChIInChI=1S/C16H16FNO/c1-2-18(15-9-4-3-5-10-15)12-16(19)13-7-6-8-14(17)11-13/h3-11H,2,12H2,1H3
InChIKeyBMLFYFSXKXQTAO-UHFFFAOYSA-N
MW257.31 g/mol
LogP3.53
Rot. Bonds5

About 2-(N-ethylanilino)-1-(3-fluorophenyl)ethanone

2-(N-ethylanilino)-1-(3-fluorophenyl)ethanone (PubChem CID 43227492) has the molecular formula C16H16FNO and a molecular weight of 257.31 g/mol. Its IUPAC name is 2-(N-ethylanilino)-1-(3-fluorophenyl)ethanone.

Molecular Properties

Compound Name2-(N-ethylanilino)-1-(3-fluorophenyl)ethanone
PubChem CID43227492
Molecular FormulaC16H16FNO
Molecular Weight257.31 g/mol
Exact Mass257.12
IUPAC Name2-(N-ethylanilino)-1-(3-fluorophenyl)ethanone
SMILESCCN(CC(=O)c1cccc(F)c1)c1ccccc1
InChIInChI=1S/C16H16FNO/c1-2-18(15-9-4-3-5-10-15)12-16(19)13-7-6-8-14(17)11-13/h3-11H,2,12H2,1H3
InChIKeyBMLFYFSXKXQTAO-UHFFFAOYSA-N
XLogP3.53
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.31
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3,4-dimethylphenyl)-2-(N-ethylanilino)ethanone
CID 21420264
3-(3-fluoro-N-phenacylanilino)propanoic acid
CID 82319710
2-(N-ethyl-3-phenylmethoxyanilino)-1-phenylethanone
CID 21420217
2-[ethyl-[2-(3-fluorophenyl)-2-oxoethyl]amino]-N,N-dimethylacetamide
CID 62036895
2-[ethyl(2-methylpropyl)amino]-1-(3-fluorophenyl)ethanone
CID 43795891
2-[ethyl(2-methoxyethyl)amino]-1-(3-fluorophenyl)ethanone
CID 54949360
2-(N-ethyl-3-fluoroanilino)-N-(4-methylphenyl)acetamide
CID 60517438
1-cyclopentyl-2-(N-ethyl-3-fluoroanilino)ethanone
CID 104750265
1-(3-fluorophenyl)-2-[methyl(pentyl)amino]ethanone
CID 43796075
2-(N-butylanilino)-1-(3-chlorophenyl)ethanone
CID 64585605
2-[ethyl(1-methoxypropan-2-yl)amino]-1-(3-fluorophenyl)ethanone
CID 55010646
1-(4-bromophenyl)-2-(N-ethyl-4-fluoroanilino)ethanone
CID 63566302

Frequently Asked Questions

What is the IUPAC name of 2-(N-ethylanilino)-1-(3-fluorophenyl)ethanone?
The IUPAC name of 2-(N-ethylanilino)-1-(3-fluorophenyl)ethanone (CID 43227492) is 2-(N-ethylanilino)-1-(3-fluorophenyl)ethanone.
What is the SMILES notation for 2-(N-ethylanilino)-1-(3-fluorophenyl)ethanone?
The canonical SMILES for 2-(N-ethylanilino)-1-(3-fluorophenyl)ethanone is CCN(CC(=O)c1cccc(F)c1)c1ccccc1.
What is the InChIKey of 2-(N-ethylanilino)-1-(3-fluorophenyl)ethanone?
The InChIKey is BMLFYFSXKXQTAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FNO/c1-2-18(15-9-4-3-5-10-15)12-16(19)13-7-6-8-14(17)11-13/h3-11H,2,12H2,1H3.
What are the key properties of 2-(N-ethylanilino)-1-(3-fluorophenyl)ethanone?
2-(N-ethylanilino)-1-(3-fluorophenyl)ethanone has a molecular weight of 257.31 g/mol, XLogP of 3.53, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-ethylanilino)-1-(3-fluorophenyl)ethanone is sourced from PubChem (CID 43227492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).