2,2,3,3-tetrafluoro-N,N-bis(2-hydroxyethyl)propanamide

C7H11F4NO3 — CID 103915330

IUPAC2,2,3,3-tetrafluoro-N,N-bis(2-hydroxyethyl)propanamide
SMILESO=C(N(CCO)CCO)C(F)(F)C(F)F
InChIInChI=1S/C7H11F4NO3/c8-5(9)7(10,11)6(15)12(1-3-13)2-4-14/h5,13-14H,1-4H2
InChIKeyUMLRRECTPURNSR-UHFFFAOYSA-N
MW233.16 g/mol
LogP-0.30
Rot. Bonds6

About 2,2,3,3-tetrafluoro-N,N-bis(2-hydroxyethyl)propanamide

2,2,3,3-tetrafluoro-N,N-bis(2-hydroxyethyl)propanamide (PubChem CID 103915330) has the molecular formula C7H11F4NO3 and a molecular weight of 233.16 g/mol. Its IUPAC name is 2,2,3,3-tetrafluoro-N,N-bis(2-hydroxyethyl)propanamide.

Molecular Properties

Compound Name2,2,3,3-tetrafluoro-N,N-bis(2-hydroxyethyl)propanamide
PubChem CID103915330
Molecular FormulaC7H11F4NO3
Molecular Weight233.16 g/mol
Exact Mass233.07
IUPAC Name2,2,3,3-tetrafluoro-N,N-bis(2-hydroxyethyl)propanamide
SMILESO=C(N(CCO)CCO)C(F)(F)C(F)F
InChIInChI=1S/C7H11F4NO3/c8-5(9)7(10,11)6(15)12(1-3-13)2-4-14/h5,13-14H,1-4H2
InChIKeyUMLRRECTPURNSR-UHFFFAOYSA-N
XLogP-0.30
TPSA60.77 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.16
LogP ≤ 5-0.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2,2,3,3-tetrafluoro-N,N-bis(2-hydroxyethyl)propanamide?
The IUPAC name of 2,2,3,3-tetrafluoro-N,N-bis(2-hydroxyethyl)propanamide (CID 103915330) is 2,2,3,3-tetrafluoro-N,N-bis(2-hydroxyethyl)propanamide.
What is the SMILES notation for 2,2,3,3-tetrafluoro-N,N-bis(2-hydroxyethyl)propanamide?
The canonical SMILES for 2,2,3,3-tetrafluoro-N,N-bis(2-hydroxyethyl)propanamide is O=C(N(CCO)CCO)C(F)(F)C(F)F.
What is the InChIKey of 2,2,3,3-tetrafluoro-N,N-bis(2-hydroxyethyl)propanamide?
The InChIKey is UMLRRECTPURNSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11F4NO3/c8-5(9)7(10,11)6(15)12(1-3-13)2-4-14/h5,13-14H,1-4H2.
What are the key properties of 2,2,3,3-tetrafluoro-N,N-bis(2-hydroxyethyl)propanamide?
2,2,3,3-tetrafluoro-N,N-bis(2-hydroxyethyl)propanamide has a molecular weight of 233.16 g/mol, XLogP of -0.30, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3,3-tetrafluoro-N,N-bis(2-hydroxyethyl)propanamide is sourced from PubChem (CID 103915330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).