2-methyl-N-[(4R)-3-oxo-2-(2,2,2-trifluoroethyl)-1,2-oxazolidin-4-yl]propanamide

C9H13F3N2O3 — CID 156532281

IUPAC2-methyl-N-[(4R)-3-oxo-2-(2,2,2-trifluoroethyl)-1,2-oxazolidin-4-yl]propanamide
SMILESCC(C)C(=O)N[C@@H]1CON(CC(F)(F)F)C1=O
InChIInChI=1S/C9H13F3N2O3/c1-5(2)7(15)13-6-3-17-14(8(6)16)4-9(10,11)12/h5-6H,3-4H2,1-2H3,(H,13,15)/t6-/m1/s1
InChIKeyLAQSAMZNYVGNTG-ZCFIWIBFSA-N
MW254.21 g/mol
LogP0.46
Rot. Bonds3

About 2-methyl-N-[(4R)-3-oxo-2-(2,2,2-trifluoroethyl)-1,2-oxazolidin-4-yl]propanamide

2-methyl-N-[(4R)-3-oxo-2-(2,2,2-trifluoroethyl)-1,2-oxazolidin-4-yl]propanamide (PubChem CID 156532281) has the molecular formula C9H13F3N2O3 and a molecular weight of 254.21 g/mol. Its IUPAC name is 2-methyl-N-[(4R)-3-oxo-2-(2,2,2-trifluoroethyl)-1,2-oxazolidin-4-yl]propanamide.

Molecular Properties

Compound Name2-methyl-N-[(4R)-3-oxo-2-(2,2,2-trifluoroethyl)-1,2-oxazolidin-4-yl]propanamide
PubChem CID156532281
Molecular FormulaC9H13F3N2O3
Molecular Weight254.21 g/mol
Exact Mass254.09
IUPAC Name2-methyl-N-[(4R)-3-oxo-2-(2,2,2-trifluoroethyl)-1,2-oxazolidin-4-yl]propanamide
SMILESCC(C)C(=O)N[C@@H]1CON(CC(F)(F)F)C1=O
InChIInChI=1S/C9H13F3N2O3/c1-5(2)7(15)13-6-3-17-14(8(6)16)4-9(10,11)12/h5-6H,3-4H2,1-2H3,(H,13,15)/t6-/m1/s1
InChIKeyLAQSAMZNYVGNTG-ZCFIWIBFSA-N
XLogP0.46
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.21
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(4R)-3-oxo-2-(2,2,2-trifluoroethyl)-1,2-oxazolidin-4-yl]propanamide?
The IUPAC name of 2-methyl-N-[(4R)-3-oxo-2-(2,2,2-trifluoroethyl)-1,2-oxazolidin-4-yl]propanamide (CID 156532281) is 2-methyl-N-[(4R)-3-oxo-2-(2,2,2-trifluoroethyl)-1,2-oxazolidin-4-yl]propanamide.
What is the SMILES notation for 2-methyl-N-[(4R)-3-oxo-2-(2,2,2-trifluoroethyl)-1,2-oxazolidin-4-yl]propanamide?
The canonical SMILES for 2-methyl-N-[(4R)-3-oxo-2-(2,2,2-trifluoroethyl)-1,2-oxazolidin-4-yl]propanamide is CC(C)C(=O)N[C@@H]1CON(CC(F)(F)F)C1=O.
What is the InChIKey of 2-methyl-N-[(4R)-3-oxo-2-(2,2,2-trifluoroethyl)-1,2-oxazolidin-4-yl]propanamide?
The InChIKey is LAQSAMZNYVGNTG-ZCFIWIBFSA-N. The full InChI is InChI=1S/C9H13F3N2O3/c1-5(2)7(15)13-6-3-17-14(8(6)16)4-9(10,11)12/h5-6H,3-4H2,1-2H3,(H,13,15)/t6-/m1/s1.
What are the key properties of 2-methyl-N-[(4R)-3-oxo-2-(2,2,2-trifluoroethyl)-1,2-oxazolidin-4-yl]propanamide?
2-methyl-N-[(4R)-3-oxo-2-(2,2,2-trifluoroethyl)-1,2-oxazolidin-4-yl]propanamide has a molecular weight of 254.21 g/mol, XLogP of 0.46, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(4R)-3-oxo-2-(2,2,2-trifluoroethyl)-1,2-oxazolidin-4-yl]propanamide is sourced from PubChem (CID 156532281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).