2,2,3,3-tetrafluoro-N-methyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)propanamide

C10H14F4N2O2 — CID 103732271

IUPAC2,2,3,3-tetrafluoro-N-methyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)propanamide
SMILESCN(CC(=O)N1CCCC1)C(=O)C(F)(F)C(F)F
InChIInChI=1S/C10H14F4N2O2/c1-15(9(18)10(13,14)8(11)12)6-7(17)16-4-2-3-5-16/h8H,2-6H2,1H3
InChIKeyWQTAWQXBOFYRCB-UHFFFAOYSA-N
MW270.23 g/mol
LogP0.97
Rot. Bonds4

About 2,2,3,3-tetrafluoro-N-methyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)propanamide

2,2,3,3-tetrafluoro-N-methyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)propanamide (PubChem CID 103732271) has the molecular formula C10H14F4N2O2 and a molecular weight of 270.23 g/mol. Its IUPAC name is 2,2,3,3-tetrafluoro-N-methyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)propanamide.

Molecular Properties

Compound Name2,2,3,3-tetrafluoro-N-methyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)propanamide
PubChem CID103732271
Molecular FormulaC10H14F4N2O2
Molecular Weight270.23 g/mol
Exact Mass270.10
IUPAC Name2,2,3,3-tetrafluoro-N-methyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)propanamide
SMILESCN(CC(=O)N1CCCC1)C(=O)C(F)(F)C(F)F
InChIInChI=1S/C10H14F4N2O2/c1-15(9(18)10(13,14)8(11)12)6-7(17)16-4-2-3-5-16/h8H,2-6H2,1H3
InChIKeyWQTAWQXBOFYRCB-UHFFFAOYSA-N
XLogP0.97
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.23
LogP ≤ 50.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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-methyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)propanamide?
The IUPAC name of 2,2,3,3-tetrafluoro-N-methyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)propanamide (CID 103732271) is 2,2,3,3-tetrafluoro-N-methyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)propanamide.
What is the SMILES notation for 2,2,3,3-tetrafluoro-N-methyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)propanamide?
The canonical SMILES for 2,2,3,3-tetrafluoro-N-methyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)propanamide is CN(CC(=O)N1CCCC1)C(=O)C(F)(F)C(F)F.
What is the InChIKey of 2,2,3,3-tetrafluoro-N-methyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)propanamide?
The InChIKey is WQTAWQXBOFYRCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F4N2O2/c1-15(9(18)10(13,14)8(11)12)6-7(17)16-4-2-3-5-16/h8H,2-6H2,1H3.
What are the key properties of 2,2,3,3-tetrafluoro-N-methyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)propanamide?
2,2,3,3-tetrafluoro-N-methyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)propanamide has a molecular weight of 270.23 g/mol, XLogP of 0.97, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3,3-tetrafluoro-N-methyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)propanamide is sourced from PubChem (CID 103732271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).