2-ethoxy-N-(2,3,4-trifluorophenyl)benzamide

C15H12F3NO2 — CID 26358716

IUPAC2-ethoxy-N-(2,3,4-trifluorophenyl)benzamide
SMILESCCOc1ccccc1C(=O)Nc1ccc(F)c(F)c1F
InChIInChI=1S/C15H12F3NO2/c1-2-21-12-6-4-3-5-9(12)15(20)19-11-8-7-10(16)13(17)14(11)18/h3-8H,2H2,1H3,(H,19,20)
InChIKeyNVRVIOHMXDVHPD-UHFFFAOYSA-N
MW295.26 g/mol
LogP3.75
Rot. Bonds4

About 2-ethoxy-N-(2,3,4-trifluorophenyl)benzamide

2-ethoxy-N-(2,3,4-trifluorophenyl)benzamide (PubChem CID 26358716) has the molecular formula C15H12F3NO2 and a molecular weight of 295.26 g/mol. Its IUPAC name is 2-ethoxy-N-(2,3,4-trifluorophenyl)benzamide.

Molecular Properties

Compound Name2-ethoxy-N-(2,3,4-trifluorophenyl)benzamide
PubChem CID26358716
Molecular FormulaC15H12F3NO2
Molecular Weight295.26 g/mol
Exact Mass295.08
IUPAC Name2-ethoxy-N-(2,3,4-trifluorophenyl)benzamide
SMILESCCOc1ccccc1C(=O)Nc1ccc(F)c(F)c1F
InChIInChI=1S/C15H12F3NO2/c1-2-21-12-6-4-3-5-9(12)15(20)19-11-8-7-10(16)13(17)14(11)18/h3-8H,2H2,1H3,(H,19,20)
InChIKeyNVRVIOHMXDVHPD-UHFFFAOYSA-N
XLogP3.75
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.26
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

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Related Compounds

2-ethoxy-N-(2-fluorophenyl)benzamide
CID 773674
2-ethoxy-N-methyl-N-[2-oxo-2-(2,3,4-trifluoroanilino)ethyl]benzamide
CID 27786720
1-[(2-ethoxyphenoxy)methyl]-3-(2,3,4-trifluorophenyl)urea
CID 108877405
2-ethoxy-N-[4-[(2-ethoxybenzoyl)amino]phenyl]benzamide
CID 1011206
N-[5-chloro-2-(trifluoromethyl)phenyl]-2-ethoxybenzamide
CID 836677
2-[[2-(2-ethoxyanilino)-2-oxoethyl]-methylamino]-N-(2,3,4-trifluorophenyl)acetamide
CID 9197791
2-ethoxy-N-(5-fluoro-1,2,3,4-tetrahydroisoquinolin-6-yl)benzamide;hydrochloride
CID 120883647
N-[2-(difluoromethoxy)phenyl]-2-ethoxybenzamide
CID 17394090
2-ethoxy-N-[4-[4-[(2-ethoxybenzoyl)amino]-3-methylphenyl]-2-methylphenyl]benzamide
CID 4556792
2-methoxy-N-[3-oxo-3-(2,3,4-trifluoroanilino)propyl]benzamide
CID 28918889
N-(2-ethoxyphenyl)-2-(2-methoxyethoxy)benzamide
CID 15943045
N-(2,4-dibromophenyl)-2-ethoxybenzamide
CID 3649234

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-(2,3,4-trifluorophenyl)benzamide?
The IUPAC name of 2-ethoxy-N-(2,3,4-trifluorophenyl)benzamide (CID 26358716) is 2-ethoxy-N-(2,3,4-trifluorophenyl)benzamide.
What is the SMILES notation for 2-ethoxy-N-(2,3,4-trifluorophenyl)benzamide?
The canonical SMILES for 2-ethoxy-N-(2,3,4-trifluorophenyl)benzamide is CCOc1ccccc1C(=O)Nc1ccc(F)c(F)c1F.
What is the InChIKey of 2-ethoxy-N-(2,3,4-trifluorophenyl)benzamide?
The InChIKey is NVRVIOHMXDVHPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12F3NO2/c1-2-21-12-6-4-3-5-9(12)15(20)19-11-8-7-10(16)13(17)14(11)18/h3-8H,2H2,1H3,(H,19,20).
What are the key properties of 2-ethoxy-N-(2,3,4-trifluorophenyl)benzamide?
2-ethoxy-N-(2,3,4-trifluorophenyl)benzamide has a molecular weight of 295.26 g/mol, XLogP of 3.75, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-(2,3,4-trifluorophenyl)benzamide is sourced from PubChem (CID 26358716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).