(2S)-2,3,3,3-tetrafluoropropanamide

C3H3F4NO — CID 7005133

IUPAC(2S)-2,3,3,3-tetrafluoropropanamide
SMILESNC(=O)[C@H](F)C(F)(F)F
InChIInChI=1S/C3H3F4NO/c4-1(2(8)9)3(5,6)7/h1H,(H2,8,9)/t1-/m0/s1
InChIKeyLBYKCQDGXLJODK-SFOWXEAESA-N
MW145.06 g/mol
LogP0.37
Rot. Bonds1

About (2S)-2,3,3,3-tetrafluoropropanamide

(2S)-2,3,3,3-tetrafluoropropanamide (PubChem CID 7005133) has the molecular formula C3H3F4NO and a molecular weight of 145.06 g/mol. Its IUPAC name is (2S)-2,3,3,3-tetrafluoropropanamide.

Molecular Properties

Compound Name(2S)-2,3,3,3-tetrafluoropropanamide
PubChem CID7005133
Molecular FormulaC3H3F4NO
Molecular Weight145.06 g/mol
Exact Mass145.02
IUPAC Name(2S)-2,3,3,3-tetrafluoropropanamide
SMILESNC(=O)[C@H](F)C(F)(F)F
InChIInChI=1S/C3H3F4NO/c4-1(2(8)9)3(5,6)7/h1H,(H2,8,9)/t1-/m0/s1
InChIKeyLBYKCQDGXLJODK-SFOWXEAESA-N
XLogP0.37
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.06
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,2-difluoroacetamide
CID 2782321
3,4,4,5,5,6,6-heptafluoro-2-methylidenehexanamide
CID 87371239
2-fluoroethyl 2,3,3,3-tetrafluoropropanoate
CID 134247673
3,4,4,4-tetrafluorobutanamide
CID 143771998
4,4,4-trideuterio-2-fluoro-3-(4-fluorophenyl)-3-hydroxybutanamide
CID 163265766
1-chloroethenyl 2,3,3,3-tetrafluoropropanoate
CID 175302669
(2R)-2-aminobutanamide;2,2,2-trifluoroacetic acid
CID 134211723
(2S)-2-fluoropropanamide
CID 129374964
3-amino-2-(trifluoromethyl)butanamide;hydrochloride
CID 174921174
2-(1,1,1-trifluoropropan-2-yloxy)butanamide
CID 66274618
2,2-bis(trifluoromethylsulfonyl)acetamide
CID 139995086
2-amino-4,4,4-trifluoro-3-oxobutanoic acid
CID 23453164

Frequently Asked Questions

What is the IUPAC name of (2S)-2,3,3,3-tetrafluoropropanamide?
The IUPAC name of (2S)-2,3,3,3-tetrafluoropropanamide (CID 7005133) is (2S)-2,3,3,3-tetrafluoropropanamide.
What is the SMILES notation for (2S)-2,3,3,3-tetrafluoropropanamide?
The canonical SMILES for (2S)-2,3,3,3-tetrafluoropropanamide is NC(=O)[C@H](F)C(F)(F)F.
What is the InChIKey of (2S)-2,3,3,3-tetrafluoropropanamide?
The InChIKey is LBYKCQDGXLJODK-SFOWXEAESA-N. The full InChI is InChI=1S/C3H3F4NO/c4-1(2(8)9)3(5,6)7/h1H,(H2,8,9)/t1-/m0/s1.
What are the key properties of (2S)-2,3,3,3-tetrafluoropropanamide?
(2S)-2,3,3,3-tetrafluoropropanamide has a molecular weight of 145.06 g/mol, XLogP of 0.37, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2,3,3,3-tetrafluoropropanamide is sourced from PubChem (CID 7005133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).