N-ethyl-2-[3-(trifluoromethoxy)anilino]acetamide

C11H13F3N2O2 — CID 28586058

IUPACN-ethyl-2-[3-(trifluoromethoxy)anilino]acetamide
SMILESCCNC(=O)CNc1cccc(OC(F)(F)F)c1
InChIInChI=1S/C11H13F3N2O2/c1-2-15-10(17)7-16-8-4-3-5-9(6-8)18-11(12,13)14/h3-6,16H,2,7H2,1H3,(H,15,17)
InChIKeyTVPRZCOMXNNOFA-UHFFFAOYSA-N
MW262.23 g/mol
LogP2.13
Rot. Bonds5

About N-ethyl-2-[3-(trifluoromethoxy)anilino]acetamide

N-ethyl-2-[3-(trifluoromethoxy)anilino]acetamide (PubChem CID 28586058) has the molecular formula C11H13F3N2O2 and a molecular weight of 262.23 g/mol. Its IUPAC name is N-ethyl-2-[3-(trifluoromethoxy)anilino]acetamide.

Molecular Properties

Compound NameN-ethyl-2-[3-(trifluoromethoxy)anilino]acetamide
PubChem CID28586058
Molecular FormulaC11H13F3N2O2
Molecular Weight262.23 g/mol
Exact Mass262.09
IUPAC NameN-ethyl-2-[3-(trifluoromethoxy)anilino]acetamide
SMILESCCNC(=O)CNc1cccc(OC(F)(F)F)c1
InChIInChI=1S/C11H13F3N2O2/c1-2-15-10(17)7-16-8-4-3-5-9(6-8)18-11(12,13)14/h3-6,16H,2,7H2,1H3,(H,15,17)
InChIKeyTVPRZCOMXNNOFA-UHFFFAOYSA-N
XLogP2.13
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.23
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-2-[3-(trifluoromethoxy)anilino]acetamide
CID 28586079
N-propan-2-yl-2-[3-(trifluoromethoxy)anilino]acetamide
CID 28586045
N-(3-methylbutyl)-2-[3-(trifluoromethoxy)anilino]acetamide
CID 61062823
1-ethyl-3-[3-(trifluoromethoxy)phenyl]urea
CID 58817774
N-(2-methylphenyl)-2-[3-(trifluoromethoxy)anilino]acetamide
CID 31773766
N-[(3,4-dimethoxyphenyl)methyl]-2-[3-(trifluoromethoxy)anilino]acetamide
CID 55544425
N-(2,3-dimethylphenyl)-2-[3-(trifluoromethoxy)anilino]acetamide
CID 31773740
N-ethyl-2-[3-(2-phenoxyethoxy)anilino]acetamide
CID 54826043
N-ethyl-2-(3-heptoxyanilino)acetamide
CID 54829186
N-ethyl-2-(3-phenylmethoxyanilino)acetamide
CID 54826259
N-(2-iodophenyl)-2-[3-(trifluoromethoxy)anilino]acetamide
CID 31774679
2-(3-methoxyanilino)-N-(2,2,2-trifluoroethyl)acetamide
CID 60646925

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[3-(trifluoromethoxy)anilino]acetamide?
The IUPAC name of N-ethyl-2-[3-(trifluoromethoxy)anilino]acetamide (CID 28586058) is N-ethyl-2-[3-(trifluoromethoxy)anilino]acetamide.
What is the SMILES notation for N-ethyl-2-[3-(trifluoromethoxy)anilino]acetamide?
The canonical SMILES for N-ethyl-2-[3-(trifluoromethoxy)anilino]acetamide is CCNC(=O)CNc1cccc(OC(F)(F)F)c1.
What is the InChIKey of N-ethyl-2-[3-(trifluoromethoxy)anilino]acetamide?
The InChIKey is TVPRZCOMXNNOFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13F3N2O2/c1-2-15-10(17)7-16-8-4-3-5-9(6-8)18-11(12,13)14/h3-6,16H,2,7H2,1H3,(H,15,17).
What are the key properties of N-ethyl-2-[3-(trifluoromethoxy)anilino]acetamide?
N-ethyl-2-[3-(trifluoromethoxy)anilino]acetamide has a molecular weight of 262.23 g/mol, XLogP of 2.13, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[3-(trifluoromethoxy)anilino]acetamide is sourced from PubChem (CID 28586058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).