2-amino-2-[3-(trifluoromethoxy)phenyl]acetamide

C9H9F3N2O2 — CID 107104709

IUPAC2-amino-2-[3-(trifluoromethoxy)phenyl]acetamide
SMILESNC(=O)C(N)c1cccc(OC(F)(F)F)c1
InChIInChI=1S/C9H9F3N2O2/c10-9(11,12)16-6-3-1-2-5(4-6)7(13)8(14)15/h1-4,7H,13H2,(H2,14,15)
InChIKeyWZKAORVTLVUTQF-UHFFFAOYSA-N
MW234.18 g/mol
LogP1.07
Rot. Bonds3

About 2-amino-2-[3-(trifluoromethoxy)phenyl]acetamide

2-amino-2-[3-(trifluoromethoxy)phenyl]acetamide (PubChem CID 107104709) has the molecular formula C9H9F3N2O2 and a molecular weight of 234.18 g/mol. Its IUPAC name is 2-amino-2-[3-(trifluoromethoxy)phenyl]acetamide.

Molecular Properties

Compound Name2-amino-2-[3-(trifluoromethoxy)phenyl]acetamide
PubChem CID107104709
Molecular FormulaC9H9F3N2O2
Molecular Weight234.18 g/mol
Exact Mass234.06
IUPAC Name2-amino-2-[3-(trifluoromethoxy)phenyl]acetamide
SMILESNC(=O)C(N)c1cccc(OC(F)(F)F)c1
InChIInChI=1S/C9H9F3N2O2/c10-9(11,12)16-6-3-1-2-5(4-6)7(13)8(14)15/h1-4,7H,13H2,(H2,14,15)
InChIKeyWZKAORVTLVUTQF-UHFFFAOYSA-N
XLogP1.07
TPSA78.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.18
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-amino-1-[3-(trifluoromethoxy)phenyl]propan-2-one
CID 138110122
3-amino-3-[3-(trifluoromethoxy)phenyl]propanamide
CID 103694228
3-amino-3-[3-(trifluoromethoxy)phenyl]propanoic acid
CID 53441902
2-amino-3-hydroxy-3-[3-(trifluoromethoxy)phenyl]propanoic acid
CID 107104802
(1S)-2,2-difluoro-1-[3-(trifluoromethoxy)phenyl]ethanamine
CID 171249830
(2R)-2-hydroxy-2-[3-(trifluoromethoxy)phenyl]acetic acid
CID 96874577
[2-hydroxy-1-[3-(trifluoromethoxy)phenyl]ethyl] carbamate
CID 175211548
2-(cyclopropylmethylamino)-2-[3-(trifluoromethoxy)phenyl]acetamide
CID 107104719
(2R)-2-[3-(trifluoromethoxy)phenyl]propanoic acid
CID 175718270
2-chloro-2-[3-(trifluoromethoxy)phenyl]acetyl chloride
CID 87204041
(1R)-2,2,2-trideuterio-1-[3-(trifluoromethoxy)phenyl]ethanamine
CID 156699931
(1S,2R)-1-amino-1-[3-(trifluoromethoxy)phenyl]propan-2-ol;hydrochloride
CID 171161777

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-[3-(trifluoromethoxy)phenyl]acetamide?
The IUPAC name of 2-amino-2-[3-(trifluoromethoxy)phenyl]acetamide (CID 107104709) is 2-amino-2-[3-(trifluoromethoxy)phenyl]acetamide.
What is the SMILES notation for 2-amino-2-[3-(trifluoromethoxy)phenyl]acetamide?
The canonical SMILES for 2-amino-2-[3-(trifluoromethoxy)phenyl]acetamide is NC(=O)C(N)c1cccc(OC(F)(F)F)c1.
What is the InChIKey of 2-amino-2-[3-(trifluoromethoxy)phenyl]acetamide?
The InChIKey is WZKAORVTLVUTQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9F3N2O2/c10-9(11,12)16-6-3-1-2-5(4-6)7(13)8(14)15/h1-4,7H,13H2,(H2,14,15).
What are the key properties of 2-amino-2-[3-(trifluoromethoxy)phenyl]acetamide?
2-amino-2-[3-(trifluoromethoxy)phenyl]acetamide has a molecular weight of 234.18 g/mol, XLogP of 1.07, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-[3-(trifluoromethoxy)phenyl]acetamide is sourced from PubChem (CID 107104709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).