(4R)-4-[(1S)-1-fluoroethyl]pyrrolidin-2-one

C6H10FNO — CID 141420560

IUPAC(4R)-4-[(1S)-1-fluoroethyl]pyrrolidin-2-one
SMILESC[C@H](F)[C@H]1CNC(=O)C1
InChIInChI=1S/C6H10FNO/c1-4(7)5-2-6(9)8-3-5/h4-5H,2-3H2,1H3,(H,8,9)/t4-,5+/m0/s1
InChIKeyHCEZHKMBZSGCRU-CRCLSJGQSA-N
MW131.15 g/mol
LogP0.48
Rot. Bonds1

About (4R)-4-[(1S)-1-fluoroethyl]pyrrolidin-2-one

(4R)-4-[(1S)-1-fluoroethyl]pyrrolidin-2-one (PubChem CID 141420560) has the molecular formula C6H10FNO and a molecular weight of 131.15 g/mol. Its IUPAC name is (4R)-4-[(1S)-1-fluoroethyl]pyrrolidin-2-one.

Molecular Properties

Compound Name(4R)-4-[(1S)-1-fluoroethyl]pyrrolidin-2-one
PubChem CID141420560
Molecular FormulaC6H10FNO
Molecular Weight131.15 g/mol
Exact Mass131.07
IUPAC Name(4R)-4-[(1S)-1-fluoroethyl]pyrrolidin-2-one
SMILESC[C@H](F)[C@H]1CNC(=O)C1
InChIInChI=1S/C6H10FNO/c1-4(7)5-2-6(9)8-3-5/h4-5H,2-3H2,1H3,(H,8,9)/t4-,5+/m0/s1
InChIKeyHCEZHKMBZSGCRU-CRCLSJGQSA-N
XLogP0.48
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.15
LogP ≤ 50.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (4R)-4-[(1S)-1-fluoroethyl]pyrrolidin-2-one?
The IUPAC name of (4R)-4-[(1S)-1-fluoroethyl]pyrrolidin-2-one (CID 141420560) is (4R)-4-[(1S)-1-fluoroethyl]pyrrolidin-2-one.
What is the SMILES notation for (4R)-4-[(1S)-1-fluoroethyl]pyrrolidin-2-one?
The canonical SMILES for (4R)-4-[(1S)-1-fluoroethyl]pyrrolidin-2-one is C[C@H](F)[C@H]1CNC(=O)C1.
What is the InChIKey of (4R)-4-[(1S)-1-fluoroethyl]pyrrolidin-2-one?
The InChIKey is HCEZHKMBZSGCRU-CRCLSJGQSA-N. The full InChI is InChI=1S/C6H10FNO/c1-4(7)5-2-6(9)8-3-5/h4-5H,2-3H2,1H3,(H,8,9)/t4-,5+/m0/s1.
What are the key properties of (4R)-4-[(1S)-1-fluoroethyl]pyrrolidin-2-one?
(4R)-4-[(1S)-1-fluoroethyl]pyrrolidin-2-one has a molecular weight of 131.15 g/mol, XLogP of 0.48, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-[(1S)-1-fluoroethyl]pyrrolidin-2-one is sourced from PubChem (CID 141420560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).