2,2,3,3-tetrafluoro-N-(3,3,3-trifluoropropyl)propanamide

C6H6F7NO — CID 103734095

IUPAC2,2,3,3-tetrafluoro-N-(3,3,3-trifluoropropyl)propanamide
SMILESO=C(NCCC(F)(F)F)C(F)(F)C(F)F
InChIInChI=1S/C6H6F7NO/c7-3(8)6(12,13)4(15)14-2-1-5(9,10)11/h3H,1-2H2,(H,14,15)
InChIKeyAVOGRDMWILADDJ-UHFFFAOYSA-N
MW241.11 g/mol
LogP1.96
Rot. Bonds4

About 2,2,3,3-tetrafluoro-N-(3,3,3-trifluoropropyl)propanamide

2,2,3,3-tetrafluoro-N-(3,3,3-trifluoropropyl)propanamide (PubChem CID 103734095) has the molecular formula C6H6F7NO and a molecular weight of 241.11 g/mol. Its IUPAC name is 2,2,3,3-tetrafluoro-N-(3,3,3-trifluoropropyl)propanamide.

Molecular Properties

Compound Name2,2,3,3-tetrafluoro-N-(3,3,3-trifluoropropyl)propanamide
PubChem CID103734095
Molecular FormulaC6H6F7NO
Molecular Weight241.11 g/mol
Exact Mass241.03
IUPAC Name2,2,3,3-tetrafluoro-N-(3,3,3-trifluoropropyl)propanamide
SMILESO=C(NCCC(F)(F)F)C(F)(F)C(F)F
InChIInChI=1S/C6H6F7NO/c7-3(8)6(12,13)4(15)14-2-1-5(9,10)11/h3H,1-2H2,(H,14,15)
InChIKeyAVOGRDMWILADDJ-UHFFFAOYSA-N
XLogP1.96
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.11
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Related Compounds

2,2,3,3-tetrafluoro-N-(4-hydroxybutyl)propanamide
CID 107168274
2-amino-2-methyl-N-(3,3,3-trifluoropropyl)propanamide
CID 63226651
N-(3,3-difluoro-2-hydroxypropyl)-2,2,3,3-tetrafluoropropanamide
CID 103770162
N-(2-amino-2-methylpropyl)-2,2,3,3-tetrafluoropropanamide;hydrochloride
CID 119627588
2,2,3,3-tetrafluoro-N-(2-piperidin-3-ylethyl)propanamide
CID 113265645
N-[2-(dimethylamino)-2-oxoethyl]-2,2,3,3-tetrafluoropropanamide
CID 103732179
2-bromo-N-(3,3,3-trifluoropropyl)propanamide
CID 107905222
N-[2-(tert-butylamino)-2-oxoethyl]-2,2,3,3-tetrafluoropropanamide
CID 113250804
2,2,3,3-tetrafluoro-N-[2-(2-methylphenyl)ethyl]propanamide
CID 113250799
2,2,3,3-tetrafluoro-N-(2-pyridin-2-ylethyl)propanamide
CID 103731925
1-amino-3-(3,3,3-trifluoropropyl)urea
CID 63227916
1-(2,2,2-trifluoroethyl)-3-(3,3,3-trifluoropropyl)urea
CID 115662977

Frequently Asked Questions

What is the IUPAC name of 2,2,3,3-tetrafluoro-N-(3,3,3-trifluoropropyl)propanamide?
The IUPAC name of 2,2,3,3-tetrafluoro-N-(3,3,3-trifluoropropyl)propanamide (CID 103734095) is 2,2,3,3-tetrafluoro-N-(3,3,3-trifluoropropyl)propanamide.
What is the SMILES notation for 2,2,3,3-tetrafluoro-N-(3,3,3-trifluoropropyl)propanamide?
The canonical SMILES for 2,2,3,3-tetrafluoro-N-(3,3,3-trifluoropropyl)propanamide is O=C(NCCC(F)(F)F)C(F)(F)C(F)F.
What is the InChIKey of 2,2,3,3-tetrafluoro-N-(3,3,3-trifluoropropyl)propanamide?
The InChIKey is AVOGRDMWILADDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6F7NO/c7-3(8)6(12,13)4(15)14-2-1-5(9,10)11/h3H,1-2H2,(H,14,15).
What are the key properties of 2,2,3,3-tetrafluoro-N-(3,3,3-trifluoropropyl)propanamide?
2,2,3,3-tetrafluoro-N-(3,3,3-trifluoropropyl)propanamide has a molecular weight of 241.11 g/mol, XLogP of 1.96, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3,3-tetrafluoro-N-(3,3,3-trifluoropropyl)propanamide is sourced from PubChem (CID 103734095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).