2-phenyl-2-(1,2,2,2-tetrafluoroethoxy)acetamide

C10H9F4NO2 — CID 68531753

IUPAC2-phenyl-2-(1,2,2,2-tetrafluoroethoxy)acetamide
SMILESNC(=O)C(OC(F)C(F)(F)F)c1ccccc1
InChIInChI=1S/C10H9F4NO2/c11-9(10(12,13)14)17-7(8(15)16)6-4-2-1-3-5-6/h1-5,7,9H,(H2,15,16)
InChIKeyGAGCVFSEJCGJEX-UHFFFAOYSA-N
MW251.18 g/mol
LogP2.09
Rot. Bonds4

About 2-phenyl-2-(1,2,2,2-tetrafluoroethoxy)acetamide

2-phenyl-2-(1,2,2,2-tetrafluoroethoxy)acetamide (PubChem CID 68531753) has the molecular formula C10H9F4NO2 and a molecular weight of 251.18 g/mol. Its IUPAC name is 2-phenyl-2-(1,2,2,2-tetrafluoroethoxy)acetamide.

Molecular Properties

Compound Name2-phenyl-2-(1,2,2,2-tetrafluoroethoxy)acetamide
PubChem CID68531753
Molecular FormulaC10H9F4NO2
Molecular Weight251.18 g/mol
Exact Mass251.06
IUPAC Name2-phenyl-2-(1,2,2,2-tetrafluoroethoxy)acetamide
SMILESNC(=O)C(OC(F)C(F)(F)F)c1ccccc1
InChIInChI=1S/C10H9F4NO2/c11-9(10(12,13)14)17-7(8(15)16)6-4-2-1-3-5-6/h1-5,7,9H,(H2,15,16)
InChIKeyGAGCVFSEJCGJEX-UHFFFAOYSA-N
XLogP2.09
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.18
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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(2R,3R)-2,3-difluoro-2-methyl-3-phenylpropanamide
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(2-amino-2-oxo-1-phenylethyl) methanesulfonate
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4,4,4-trifluoro-2-hydroxy-2-methyl-3-phenylbutanamide
CID 175410360
(2R)-2-phenyl-2-(2,2,2-trifluoroethoxy)acetic acid;hydrochloride
CID 66764263
(2-amino-2-oxo-1-phenylethyl) 4-cyclohexylbutanoate
CID 43038716
(2R,3R)-2-amino-3-fluoro-3-phenylpropanamide
CID 13182012
methyl 2-phenyl-2-(trifluoromethylsulfonyloxy)acetate
CID 14104123
methyl 2-amino-4,4,4-trifluoro-3-phenylbutanoate
CID 68725831
(2R)-2-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]oxy-2-phenylacetic acid
CID 102450257

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-2-(1,2,2,2-tetrafluoroethoxy)acetamide?
The IUPAC name of 2-phenyl-2-(1,2,2,2-tetrafluoroethoxy)acetamide (CID 68531753) is 2-phenyl-2-(1,2,2,2-tetrafluoroethoxy)acetamide.
What is the SMILES notation for 2-phenyl-2-(1,2,2,2-tetrafluoroethoxy)acetamide?
The canonical SMILES for 2-phenyl-2-(1,2,2,2-tetrafluoroethoxy)acetamide is NC(=O)C(OC(F)C(F)(F)F)c1ccccc1.
What is the InChIKey of 2-phenyl-2-(1,2,2,2-tetrafluoroethoxy)acetamide?
The InChIKey is GAGCVFSEJCGJEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F4NO2/c11-9(10(12,13)14)17-7(8(15)16)6-4-2-1-3-5-6/h1-5,7,9H,(H2,15,16).
What are the key properties of 2-phenyl-2-(1,2,2,2-tetrafluoroethoxy)acetamide?
2-phenyl-2-(1,2,2,2-tetrafluoroethoxy)acetamide has a molecular weight of 251.18 g/mol, XLogP of 2.09, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-2-(1,2,2,2-tetrafluoroethoxy)acetamide is sourced from PubChem (CID 68531753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).