N-[2-[4-(4,4-dimethyl-2-oxo-1,3-oxazolidin-3-yl)piperidin-1-yl]-2-oxoethyl]-2,2,2-trifluoroacetamide

C14H20F3N3O4 — CID 3669319

IUPACN-[2-[4-(4,4-dimethyl-2-oxo-1,3-oxazolidin-3-yl)piperidin-1-yl]-2-oxoethyl]-2,2,2-trifluoroacetamide
SMILESCC1(C)COC(=O)N1C1CCN(C(=O)CNC(=O)C(F)(F)F)CC1
InChIInChI=1S/C14H20F3N3O4/c1-13(2)8-24-12(23)20(13)9-3-5-19(6-4-9)10(21)7-18-11(22)14(15,16)17/h9H,3-8H2,1-2H3,(H,18,22)
InChIKeyOXSFVAZGDDOJDM-UHFFFAOYSA-N
MW351.33 g/mol
LogP0.89
Rot. Bonds3

About N-[2-[4-(4,4-dimethyl-2-oxo-1,3-oxazolidin-3-yl)piperidin-1-yl]-2-oxoethyl]-2,2,2-trifluoroacetamide

N-[2-[4-(4,4-dimethyl-2-oxo-1,3-oxazolidin-3-yl)piperidin-1-yl]-2-oxoethyl]-2,2,2-trifluoroacetamide (PubChem CID 3669319) has the molecular formula C14H20F3N3O4 and a molecular weight of 351.33 g/mol. Its IUPAC name is N-[2-[4-(4,4-dimethyl-2-oxo-1,3-oxazolidin-3-yl)piperidin-1-yl]-2-oxoethyl]-2,2,2-trifluoroacetamide.

Molecular Properties

Compound NameN-[2-[4-(4,4-dimethyl-2-oxo-1,3-oxazolidin-3-yl)piperidin-1-yl]-2-oxoethyl]-2,2,2-trifluoroacetamide
PubChem CID3669319
Molecular FormulaC14H20F3N3O4
Molecular Weight351.33 g/mol
Exact Mass351.14
IUPAC NameN-[2-[4-(4,4-dimethyl-2-oxo-1,3-oxazolidin-3-yl)piperidin-1-yl]-2-oxoethyl]-2,2,2-trifluoroacetamide
SMILESCC1(C)COC(=O)N1C1CCN(C(=O)CNC(=O)C(F)(F)F)CC1
InChIInChI=1S/C14H20F3N3O4/c1-13(2)8-24-12(23)20(13)9-3-5-19(6-4-9)10(21)7-18-11(22)14(15,16)17/h9H,3-8H2,1-2H3,(H,18,22)
InChIKeyOXSFVAZGDDOJDM-UHFFFAOYSA-N
XLogP0.89
TPSA78.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.33
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-[4-(4,4-dimethyl-2-oxo-1,3-oxazolidin-3-yl)piperidin-1-yl]-2-oxoethyl]-2,2,2-trifluoroacetamide?
The IUPAC name of N-[2-[4-(4,4-dimethyl-2-oxo-1,3-oxazolidin-3-yl)piperidin-1-yl]-2-oxoethyl]-2,2,2-trifluoroacetamide (CID 3669319) is N-[2-[4-(4,4-dimethyl-2-oxo-1,3-oxazolidin-3-yl)piperidin-1-yl]-2-oxoethyl]-2,2,2-trifluoroacetamide.
What is the SMILES notation for N-[2-[4-(4,4-dimethyl-2-oxo-1,3-oxazolidin-3-yl)piperidin-1-yl]-2-oxoethyl]-2,2,2-trifluoroacetamide?
The canonical SMILES for N-[2-[4-(4,4-dimethyl-2-oxo-1,3-oxazolidin-3-yl)piperidin-1-yl]-2-oxoethyl]-2,2,2-trifluoroacetamide is CC1(C)COC(=O)N1C1CCN(C(=O)CNC(=O)C(F)(F)F)CC1.
What is the InChIKey of N-[2-[4-(4,4-dimethyl-2-oxo-1,3-oxazolidin-3-yl)piperidin-1-yl]-2-oxoethyl]-2,2,2-trifluoroacetamide?
The InChIKey is OXSFVAZGDDOJDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20F3N3O4/c1-13(2)8-24-12(23)20(13)9-3-5-19(6-4-9)10(21)7-18-11(22)14(15,16)17/h9H,3-8H2,1-2H3,(H,18,22).
What are the key properties of N-[2-[4-(4,4-dimethyl-2-oxo-1,3-oxazolidin-3-yl)piperidin-1-yl]-2-oxoethyl]-2,2,2-trifluoroacetamide?
N-[2-[4-(4,4-dimethyl-2-oxo-1,3-oxazolidin-3-yl)piperidin-1-yl]-2-oxoethyl]-2,2,2-trifluoroacetamide has a molecular weight of 351.33 g/mol, XLogP of 0.89, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-(4,4-dimethyl-2-oxo-1,3-oxazolidin-3-yl)piperidin-1-yl]-2-oxoethyl]-2,2,2-trifluoroacetamide is sourced from PubChem (CID 3669319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).