2-(ethylamino)-3-fluoro-N-(2,2,2-trifluoroethyl)benzamide

C11H12F4N2O — CID 55100188

IUPAC2-(ethylamino)-3-fluoro-N-(2,2,2-trifluoroethyl)benzamide
SMILESCCNc1c(F)cccc1C(=O)NCC(F)(F)F
InChIInChI=1S/C11H12F4N2O/c1-2-16-9-7(4-3-5-8(9)12)10(18)17-6-11(13,14)15/h3-5,16H,2,6H2,1H3,(H,17,18)
InChIKeyLUEVJUMFIPPIGS-UHFFFAOYSA-N
MW264.22 g/mol
LogP2.55
Rot. Bonds4

About 2-(ethylamino)-3-fluoro-N-(2,2,2-trifluoroethyl)benzamide

2-(ethylamino)-3-fluoro-N-(2,2,2-trifluoroethyl)benzamide (PubChem CID 55100188) has the molecular formula C11H12F4N2O and a molecular weight of 264.22 g/mol. Its IUPAC name is 2-(ethylamino)-3-fluoro-N-(2,2,2-trifluoroethyl)benzamide.

Molecular Properties

Compound Name2-(ethylamino)-3-fluoro-N-(2,2,2-trifluoroethyl)benzamide
PubChem CID55100188
Molecular FormulaC11H12F4N2O
Molecular Weight264.22 g/mol
Exact Mass264.09
IUPAC Name2-(ethylamino)-3-fluoro-N-(2,2,2-trifluoroethyl)benzamide
SMILESCCNc1c(F)cccc1C(=O)NCC(F)(F)F
InChIInChI=1S/C11H12F4N2O/c1-2-16-9-7(4-3-5-8(9)12)10(18)17-6-11(13,14)15/h3-5,16H,2,6H2,1H3,(H,17,18)
InChIKeyLUEVJUMFIPPIGS-UHFFFAOYSA-N
XLogP2.55
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.22
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(ethylamino)-3-fluoro-N-(2,2,2-trifluoroethyl)benzamide 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

N-ethyl-2-(ethylamino)-3-fluorobenzamide
CID 62648907
N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-(ethylamino)-3-fluorobenzamide
CID 62650035
N-(1-amino-2-methyl-1-oxopropan-2-yl)-2-(ethylamino)-3-fluorobenzamide
CID 62660729
2-fluoro-N-(2,2,2-trifluoroethyl)benzamide
CID 51072699
2-(ethylamino)-3-fluoro-N-(2-phenylethyl)benzamide
CID 62648927
N-(2,2-dimethylbutyl)-3-fluoro-2-(propylamino)benzamide
CID 103464511
2-(ethylamino)-N-[2-(ethylsulfamoyl)ethyl]-3-fluorobenzamide
CID 106342576
N-[(4-bromophenyl)methyl]-2-(ethylamino)-3-fluorobenzamide
CID 62649718
2-(ethylamino)-3-fluoro-N-(pyridin-4-ylmethyl)benzamide
CID 62649385
2-(ethylamino)-3-fluoro-N-(thiophen-3-ylmethyl)benzamide
CID 63248048
N-(cyclohexylmethyl)-2-(ethylamino)-3-fluorobenzamide
CID 62661338
N-(2-butoxyethyl)-2-(ethylamino)-3-fluorobenzamide
CID 62660550

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-3-fluoro-N-(2,2,2-trifluoroethyl)benzamide?
The IUPAC name of 2-(ethylamino)-3-fluoro-N-(2,2,2-trifluoroethyl)benzamide (CID 55100188) is 2-(ethylamino)-3-fluoro-N-(2,2,2-trifluoroethyl)benzamide.
What is the SMILES notation for 2-(ethylamino)-3-fluoro-N-(2,2,2-trifluoroethyl)benzamide?
The canonical SMILES for 2-(ethylamino)-3-fluoro-N-(2,2,2-trifluoroethyl)benzamide is CCNc1c(F)cccc1C(=O)NCC(F)(F)F.
What is the InChIKey of 2-(ethylamino)-3-fluoro-N-(2,2,2-trifluoroethyl)benzamide?
The InChIKey is LUEVJUMFIPPIGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12F4N2O/c1-2-16-9-7(4-3-5-8(9)12)10(18)17-6-11(13,14)15/h3-5,16H,2,6H2,1H3,(H,17,18).
What are the key properties of 2-(ethylamino)-3-fluoro-N-(2,2,2-trifluoroethyl)benzamide?
2-(ethylamino)-3-fluoro-N-(2,2,2-trifluoroethyl)benzamide has a molecular weight of 264.22 g/mol, XLogP of 2.55, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-3-fluoro-N-(2,2,2-trifluoroethyl)benzamide is sourced from PubChem (CID 55100188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).