N-ethyl-2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)-N-prop-2-enylpropanamide

C11H10F11NO2 — CID 177282150

IUPACN-ethyl-2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)-N-prop-2-enylpropanamide
SMILESC=CCN(CC)C(=O)C(F)(OC(F)(F)C(F)(F)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C11H10F11NO2/c1-3-5-23(4-2)6(24)7(12,9(15,16)17)25-11(21,22)8(13,14)10(18,19)20/h3H,1,4-5H2,2H3
InChIKeyLWIYZLZTFASKHN-UHFFFAOYSA-N
MW397.18 g/mol
LogP4.06
Rot. Bonds7

About N-ethyl-2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)-N-prop-2-enylpropanamide

N-ethyl-2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)-N-prop-2-enylpropanamide (PubChem CID 177282150) has the molecular formula C11H10F11NO2 and a molecular weight of 397.18 g/mol. Its IUPAC name is N-ethyl-2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)-N-prop-2-enylpropanamide.

Molecular Properties

Compound NameN-ethyl-2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)-N-prop-2-enylpropanamide
PubChem CID177282150
Molecular FormulaC11H10F11NO2
Molecular Weight397.18 g/mol
Exact Mass397.05
IUPAC NameN-ethyl-2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)-N-prop-2-enylpropanamide
SMILESC=CCN(CC)C(=O)C(F)(OC(F)(F)C(F)(F)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C11H10F11NO2/c1-3-5-23(4-2)6(24)7(12,9(15,16)17)25-11(21,22)8(13,14)10(18,19)20/h3H,1,4-5H2,2H3
InChIKeyLWIYZLZTFASKHN-UHFFFAOYSA-N
XLogP4.06
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.18
LogP ≤ 54.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-Allylperfluoro-2-propoxypropanamide
CID 71672266
N,N-Diethyl-2,3,3,3-tetrafluoro-2-(heptafluoropropoxy)propanamide
CID 71672900
N-methyl-N-allyl-perfluoro-2-methyl-3-oxa-hexanamide
CID 134694488
N-methyl-N-allyl-perfluoro-2,5-dimethyl-3,6-dioxa-nonanamide
CID 134694578
3,3,3-trifluoro-1-(1-methyl-2H-azet-1-ium-1-yl)-2-(1,1,2-trifluoroethoxy)-2-(trifluoromethyl)propan-1-one
CID 22966653
3,3,3-trifluoro-N-methyl-N-prop-2-enyl-2-(1,1,2-trifluoroethoxy)-2-(trifluoromethyl)propanamide
CID 22966665
2,3,3,3-tetrafluoro-2-(1,1,3,3,3-pentafluoropropoxy)-N-prop-2-enylpropanamide
CID 53796591
2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]-N-methyl-N-prop-2-enylpropanamide
CID 54025923
2,3,3,3-tetrafluoro-2-(fluoromethoxy)-N-methyl-N-prop-2-enylpropanamide
CID 167353316
2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)-N,N-dipropylpropanamide
CID 71673114
2,2,3,3-tetrafluoro-N-(2-methoxyethyl)-N-prop-2-enylpropanamide
CID 103528737
2,2,3,3,3-pentafluoro-N-(2-methoxyethyl)-N-prop-2-enylpropanamide
CID 114038267

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)-N-prop-2-enylpropanamide?
The IUPAC name of N-ethyl-2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)-N-prop-2-enylpropanamide (CID 177282150) is N-ethyl-2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)-N-prop-2-enylpropanamide.
What is the SMILES notation for N-ethyl-2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)-N-prop-2-enylpropanamide?
The canonical SMILES for N-ethyl-2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)-N-prop-2-enylpropanamide is C=CCN(CC)C(=O)C(F)(OC(F)(F)C(F)(F)C(F)(F)F)C(F)(F)F.
What is the InChIKey of N-ethyl-2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)-N-prop-2-enylpropanamide?
The InChIKey is LWIYZLZTFASKHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10F11NO2/c1-3-5-23(4-2)6(24)7(12,9(15,16)17)25-11(21,22)8(13,14)10(18,19)20/h3H,1,4-5H2,2H3.
What are the key properties of N-ethyl-2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)-N-prop-2-enylpropanamide?
N-ethyl-2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)-N-prop-2-enylpropanamide has a molecular weight of 397.18 g/mol, XLogP of 4.06, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)-N-prop-2-enylpropanamide is sourced from PubChem (CID 177282150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).