3-(2-ethoxyanilino)-N-[2-(trifluoromethyl)phenyl]propanamide

C18H19F3N2O2 — CID 109039806

IUPAC3-(2-ethoxyanilino)-N-[2-(trifluoromethyl)phenyl]propanamide
SMILESCCOc1ccccc1NCCC(=O)Nc1ccccc1C(F)(F)F
InChIInChI=1S/C18H19F3N2O2/c1-2-25-16-10-6-5-9-15(16)22-12-11-17(24)23-14-8-4-3-7-13(14)18(19,20)21/h3-10,22H,2,11-12H2,1H3,(H,23,24)
InChIKeyQEUNXMKNOVZFDZ-UHFFFAOYSA-N
MW352.36 g/mol
LogP4.54
Rot. Bonds7

About 3-(2-ethoxyanilino)-N-[2-(trifluoromethyl)phenyl]propanamide

3-(2-ethoxyanilino)-N-[2-(trifluoromethyl)phenyl]propanamide (PubChem CID 109039806) has the molecular formula C18H19F3N2O2 and a molecular weight of 352.36 g/mol. Its IUPAC name is 3-(2-ethoxyanilino)-N-[2-(trifluoromethyl)phenyl]propanamide.

Molecular Properties

Compound Name3-(2-ethoxyanilino)-N-[2-(trifluoromethyl)phenyl]propanamide
PubChem CID109039806
Molecular FormulaC18H19F3N2O2
Molecular Weight352.36 g/mol
Exact Mass352.14
IUPAC Name3-(2-ethoxyanilino)-N-[2-(trifluoromethyl)phenyl]propanamide
SMILESCCOc1ccccc1NCCC(=O)Nc1ccccc1C(F)(F)F
InChIInChI=1S/C18H19F3N2O2/c1-2-25-16-10-6-5-9-15(16)22-12-11-17(24)23-14-8-4-3-7-13(14)18(19,20)21/h3-10,22H,2,11-12H2,1H3,(H,23,24)
InChIKeyQEUNXMKNOVZFDZ-UHFFFAOYSA-N
XLogP4.54
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.36
LogP ≤ 54.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[2-(2-ethoxyanilino)-2-oxoethyl]-methylamino]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 9286510
3-(2-chloroanilino)-N-[2-(trifluoromethyl)phenyl]propanamide
CID 109037892
3-(2-ethoxyanilino)-N-[3-(trifluoromethyl)phenyl]propanamide
CID 109039807
3-(2,3-dimethylanilino)-N-[2-(trifluoromethyl)phenyl]propanamide
CID 109036048
3-(5-chloro-2-methoxyanilino)-N-[2-(trifluoromethyl)phenyl]propanamide
CID 109039146
3-(2-methoxyphenoxy)-N-[2-(trifluoromethyl)phenyl]propanamide
CID 17034567
3-(2,6-difluoroanilino)-N-(2-ethoxyphenyl)propanamide
CID 109039796
3-(5-chloro-2-methylanilino)-N-[2-(trifluoromethyl)phenyl]propanamide
CID 109038453
2-[2-(2-methoxyethoxy)anilino]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 47077742
3-(3,4-dimethylanilino)-N-(2-ethoxyphenyl)propanamide
CID 109035537
3-(2-ethoxyphenyl)-N-[2-(trifluoromethyl)phenyl]prop-2-enamide
CID 3562949
3-(2-ethoxyanilino)propanamide
CID 43131857

Frequently Asked Questions

What is the IUPAC name of 3-(2-ethoxyanilino)-N-[2-(trifluoromethyl)phenyl]propanamide?
The IUPAC name of 3-(2-ethoxyanilino)-N-[2-(trifluoromethyl)phenyl]propanamide (CID 109039806) is 3-(2-ethoxyanilino)-N-[2-(trifluoromethyl)phenyl]propanamide.
What is the SMILES notation for 3-(2-ethoxyanilino)-N-[2-(trifluoromethyl)phenyl]propanamide?
The canonical SMILES for 3-(2-ethoxyanilino)-N-[2-(trifluoromethyl)phenyl]propanamide is CCOc1ccccc1NCCC(=O)Nc1ccccc1C(F)(F)F.
What is the InChIKey of 3-(2-ethoxyanilino)-N-[2-(trifluoromethyl)phenyl]propanamide?
The InChIKey is QEUNXMKNOVZFDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19F3N2O2/c1-2-25-16-10-6-5-9-15(16)22-12-11-17(24)23-14-8-4-3-7-13(14)18(19,20)21/h3-10,22H,2,11-12H2,1H3,(H,23,24).
What are the key properties of 3-(2-ethoxyanilino)-N-[2-(trifluoromethyl)phenyl]propanamide?
3-(2-ethoxyanilino)-N-[2-(trifluoromethyl)phenyl]propanamide has a molecular weight of 352.36 g/mol, XLogP of 4.54, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-ethoxyanilino)-N-[2-(trifluoromethyl)phenyl]propanamide is sourced from PubChem (CID 109039806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).