2-amino-N-[4-chloro-2-(2,2,2-trifluoroethoxy)phenyl]acetamide

C10H10ClF3N2O2 — CID 119324701

IUPAC2-amino-N-[4-chloro-2-(2,2,2-trifluoroethoxy)phenyl]acetamide
SMILESNCC(=O)Nc1ccc(Cl)cc1OCC(F)(F)F
InChIInChI=1S/C10H10ClF3N2O2/c11-6-1-2-7(16-9(17)4-15)8(3-6)18-5-10(12,13)14/h1-3H,4-5,15H2,(H,16,17)
InChIKeyPTBKROMCZNYZRO-UHFFFAOYSA-N
MW282.65 g/mol
LogP2.18
Rot. Bonds4

About 2-amino-N-[4-chloro-2-(2,2,2-trifluoroethoxy)phenyl]acetamide

2-amino-N-[4-chloro-2-(2,2,2-trifluoroethoxy)phenyl]acetamide (PubChem CID 119324701) has the molecular formula C10H10ClF3N2O2 and a molecular weight of 282.65 g/mol. Its IUPAC name is 2-amino-N-[4-chloro-2-(2,2,2-trifluoroethoxy)phenyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[4-chloro-2-(2,2,2-trifluoroethoxy)phenyl]acetamide
PubChem CID119324701
Molecular FormulaC10H10ClF3N2O2
Molecular Weight282.65 g/mol
Exact Mass282.04
IUPAC Name2-amino-N-[4-chloro-2-(2,2,2-trifluoroethoxy)phenyl]acetamide
SMILESNCC(=O)Nc1ccc(Cl)cc1OCC(F)(F)F
InChIInChI=1S/C10H10ClF3N2O2/c11-6-1-2-7(16-9(17)4-15)8(3-6)18-5-10(12,13)14/h1-3H,4-5,15H2,(H,16,17)
InChIKeyPTBKROMCZNYZRO-UHFFFAOYSA-N
XLogP2.18
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.65
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(4-chloro-2-ethoxyphenyl)acetamide;hydrochloride
CID 119337558
N-[4-chloro-2-(2,2,2-trifluoroethoxy)phenyl]-2-(2-methoxyethylamino)acetamide
CID 119785490
2-(4-chlorophenoxy)-N-[5-chloro-2-(2,2,2-trifluoroethoxy)phenyl]acetamide
CID 134027239
N-[4-chloro-2-(2,2,2-trifluoroethoxy)phenyl]-2-(1-methylpyrazol-4-yl)acetamide
CID 56790130
4-[[4-chloro-2-(2,2,2-trifluoroethoxy)phenyl]carbamoyl]cyclohexane-1-carboxylic acid
CID 120673647
3-amino-N-[4-chloro-2-(2,2,2-trifluoroethoxy)phenyl]cyclopentane-1-carboxamide
CID 119785468
4-amino-N-[4-methyl-2-(2,2,2-trifluoroethoxy)phenyl]butanamide
CID 119302270
N-[4-chloro-2-(2,2,2-trifluoroethoxy)phenyl]-1H-pyrazole-5-carboxamide
CID 56790133
3-amino-N-[4-chloro-2-(2,2,2-trifluoroethoxy)phenyl]cyclopentane-1-carboxamide;hydrochloride
CID 119785467
7-amino-N-[4-fluoro-2-(2,2,2-trifluoroethoxy)phenyl]heptanamide;hydrochloride
CID 119785431
4-chloro-2-(2,2,2-trifluoroethoxy)benzoic acid
CID 61379733
2-(4-chlorophenoxy)-N-[4-chloro-2-(trifluoromethyl)phenyl]acetamide
CID 1352117

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[4-chloro-2-(2,2,2-trifluoroethoxy)phenyl]acetamide?
The IUPAC name of 2-amino-N-[4-chloro-2-(2,2,2-trifluoroethoxy)phenyl]acetamide (CID 119324701) is 2-amino-N-[4-chloro-2-(2,2,2-trifluoroethoxy)phenyl]acetamide.
What is the SMILES notation for 2-amino-N-[4-chloro-2-(2,2,2-trifluoroethoxy)phenyl]acetamide?
The canonical SMILES for 2-amino-N-[4-chloro-2-(2,2,2-trifluoroethoxy)phenyl]acetamide is NCC(=O)Nc1ccc(Cl)cc1OCC(F)(F)F.
What is the InChIKey of 2-amino-N-[4-chloro-2-(2,2,2-trifluoroethoxy)phenyl]acetamide?
The InChIKey is PTBKROMCZNYZRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClF3N2O2/c11-6-1-2-7(16-9(17)4-15)8(3-6)18-5-10(12,13)14/h1-3H,4-5,15H2,(H,16,17).
What are the key properties of 2-amino-N-[4-chloro-2-(2,2,2-trifluoroethoxy)phenyl]acetamide?
2-amino-N-[4-chloro-2-(2,2,2-trifluoroethoxy)phenyl]acetamide has a molecular weight of 282.65 g/mol, XLogP of 2.18, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[4-chloro-2-(2,2,2-trifluoroethoxy)phenyl]acetamide is sourced from PubChem (CID 119324701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).