3,3,3-trifluoro-N-[(1R)-2-oxocyclopentyl]propanamide

C8H10F3NO2 — CID 58413551

IUPAC3,3,3-trifluoro-N-[(1R)-2-oxocyclopentyl]propanamide
SMILESO=C(CC(F)(F)F)N[C@@H]1CCCC1=O
InChIInChI=1S/C8H10F3NO2/c9-8(10,11)4-7(14)12-5-2-1-3-6(5)13/h5H,1-4H2,(H,12,14)/t5-/m1/s1
InChIKeyFJUXZHALMYWRBF-RXMQYKEDSA-N
MW209.17 g/mol
LogP1.18
Rot. Bonds2

About 3,3,3-trifluoro-N-[(1R)-2-oxocyclopentyl]propanamide

3,3,3-trifluoro-N-[(1R)-2-oxocyclopentyl]propanamide (PubChem CID 58413551) has the molecular formula C8H10F3NO2 and a molecular weight of 209.17 g/mol. Its IUPAC name is 3,3,3-trifluoro-N-[(1R)-2-oxocyclopentyl]propanamide.

Molecular Properties

Compound Name3,3,3-trifluoro-N-[(1R)-2-oxocyclopentyl]propanamide
PubChem CID58413551
Molecular FormulaC8H10F3NO2
Molecular Weight209.17 g/mol
Exact Mass209.07
IUPAC Name3,3,3-trifluoro-N-[(1R)-2-oxocyclopentyl]propanamide
SMILESO=C(CC(F)(F)F)N[C@@H]1CCCC1=O
InChIInChI=1S/C8H10F3NO2/c9-8(10,11)4-7(14)12-5-2-1-3-6(5)13/h5H,1-4H2,(H,12,14)/t5-/m1/s1
InChIKeyFJUXZHALMYWRBF-RXMQYKEDSA-N
XLogP1.18
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.17
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,3,3-trifluoro-N-[(1R)-2-oxocyclopentyl]propanamide?
The IUPAC name of 3,3,3-trifluoro-N-[(1R)-2-oxocyclopentyl]propanamide (CID 58413551) is 3,3,3-trifluoro-N-[(1R)-2-oxocyclopentyl]propanamide.
What is the SMILES notation for 3,3,3-trifluoro-N-[(1R)-2-oxocyclopentyl]propanamide?
The canonical SMILES for 3,3,3-trifluoro-N-[(1R)-2-oxocyclopentyl]propanamide is O=C(CC(F)(F)F)N[C@@H]1CCCC1=O.
What is the InChIKey of 3,3,3-trifluoro-N-[(1R)-2-oxocyclopentyl]propanamide?
The InChIKey is FJUXZHALMYWRBF-RXMQYKEDSA-N. The full InChI is InChI=1S/C8H10F3NO2/c9-8(10,11)4-7(14)12-5-2-1-3-6(5)13/h5H,1-4H2,(H,12,14)/t5-/m1/s1.
What are the key properties of 3,3,3-trifluoro-N-[(1R)-2-oxocyclopentyl]propanamide?
3,3,3-trifluoro-N-[(1R)-2-oxocyclopentyl]propanamide has a molecular weight of 209.17 g/mol, XLogP of 1.18, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3,3-trifluoro-N-[(1R)-2-oxocyclopentyl]propanamide is sourced from PubChem (CID 58413551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).