2-(cyclopropylamino)-N-[2-(2,2,2-trifluoroethoxy)phenyl]acetamide

C13H15F3N2O2 — CID 60716131

IUPAC2-(cyclopropylamino)-N-[2-(2,2,2-trifluoroethoxy)phenyl]acetamide
SMILESO=C(CNC1CC1)Nc1ccccc1OCC(F)(F)F
InChIInChI=1S/C13H15F3N2O2/c14-13(15,16)8-20-11-4-2-1-3-10(11)18-12(19)7-17-9-5-6-9/h1-4,9,17H,5-8H2,(H,18,19)
InChIKeyZHJWKMVKTYWFHU-UHFFFAOYSA-N
MW288.27 g/mol
LogP2.32
Rot. Bonds6

About 2-(cyclopropylamino)-N-[2-(2,2,2-trifluoroethoxy)phenyl]acetamide

2-(cyclopropylamino)-N-[2-(2,2,2-trifluoroethoxy)phenyl]acetamide (PubChem CID 60716131) has the molecular formula C13H15F3N2O2 and a molecular weight of 288.27 g/mol. Its IUPAC name is 2-(cyclopropylamino)-N-[2-(2,2,2-trifluoroethoxy)phenyl]acetamide.

Molecular Properties

Compound Name2-(cyclopropylamino)-N-[2-(2,2,2-trifluoroethoxy)phenyl]acetamide
PubChem CID60716131
Molecular FormulaC13H15F3N2O2
Molecular Weight288.27 g/mol
Exact Mass288.11
IUPAC Name2-(cyclopropylamino)-N-[2-(2,2,2-trifluoroethoxy)phenyl]acetamide
SMILESO=C(CNC1CC1)Nc1ccccc1OCC(F)(F)F
InChIInChI=1S/C13H15F3N2O2/c14-13(15,16)8-20-11-4-2-1-3-10(11)18-12(19)7-17-9-5-6-9/h1-4,9,17H,5-8H2,(H,18,19)
InChIKeyZHJWKMVKTYWFHU-UHFFFAOYSA-N
XLogP2.32
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.27
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cyclopropylamino)-N-(2-phenoxyphenyl)acetamide
CID 60647217
2-(cycloheptylamino)-N-[2-(trifluoromethyl)phenyl]acetamide
CID 109005582
2-(cyclopropylamino)-N-[4-(2,2,2-trifluoroethoxy)phenyl]acetamide
CID 60841072
tert-butyl N-[2-oxo-2-[2-(2,2,2-trifluoroethoxy)anilino]ethyl]carbamate
CID 60596060
2-cyano-N-[2-(2,2,2-trifluoroethoxy)phenyl]acetamide
CID 168520948
3-piperidin-4-yl-N-[2-(2,2,2-trifluoroethoxy)phenyl]butanamide
CID 119700416
N-(2-tert-butylphenyl)-2-(cyclopropylamino)acetamide
CID 54773215
2-(methylamino)-N-[2-methyl-3-(2,2,2-trifluoroethoxy)phenyl]acetamide
CID 119769160
2-[(1,1-dioxothiolan-3-yl)amino]-N-(2-ethoxyphenyl)acetamide
CID 109001684
N-(3,4-dimethylcyclohexyl)-2-(2,2,2-trifluoroethoxy)aniline
CID 64734525
3-(2-chlorophenyl)-N-[2-(2,2,2-trifluoroethoxy)phenyl]propanamide
CID 33370497
2-[5-chloro-2-(2,2,2-trifluoroethoxy)anilino]-N-(2-methoxyphenyl)acetamide
CID 33482506

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-N-[2-(2,2,2-trifluoroethoxy)phenyl]acetamide?
The IUPAC name of 2-(cyclopropylamino)-N-[2-(2,2,2-trifluoroethoxy)phenyl]acetamide (CID 60716131) is 2-(cyclopropylamino)-N-[2-(2,2,2-trifluoroethoxy)phenyl]acetamide.
What is the SMILES notation for 2-(cyclopropylamino)-N-[2-(2,2,2-trifluoroethoxy)phenyl]acetamide?
The canonical SMILES for 2-(cyclopropylamino)-N-[2-(2,2,2-trifluoroethoxy)phenyl]acetamide is O=C(CNC1CC1)Nc1ccccc1OCC(F)(F)F.
What is the InChIKey of 2-(cyclopropylamino)-N-[2-(2,2,2-trifluoroethoxy)phenyl]acetamide?
The InChIKey is ZHJWKMVKTYWFHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15F3N2O2/c14-13(15,16)8-20-11-4-2-1-3-10(11)18-12(19)7-17-9-5-6-9/h1-4,9,17H,5-8H2,(H,18,19).
What are the key properties of 2-(cyclopropylamino)-N-[2-(2,2,2-trifluoroethoxy)phenyl]acetamide?
2-(cyclopropylamino)-N-[2-(2,2,2-trifluoroethoxy)phenyl]acetamide has a molecular weight of 288.27 g/mol, XLogP of 2.32, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-N-[2-(2,2,2-trifluoroethoxy)phenyl]acetamide is sourced from PubChem (CID 60716131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).