2,2,2-trifluoro-N-[2-[4-[4-(2-methylpropyl)-2-oxo-1,3-oxazolidin-3-yl]piperidin-1-yl]-2-oxoethyl]acetamide

C16H24F3N3O4 — CID 3757323

IUPAC2,2,2-trifluoro-N-[2-[4-[4-(2-methylpropyl)-2-oxo-1,3-oxazolidin-3-yl]piperidin-1-yl]-2-oxoethyl]acetamide
SMILESCC(C)CC1COC(=O)N1C1CCN(C(=O)CNC(=O)C(F)(F)F)CC1
InChIInChI=1S/C16H24F3N3O4/c1-10(2)7-12-9-26-15(25)22(12)11-3-5-21(6-4-11)13(23)8-20-14(24)16(17,18)19/h10-12H,3-9H2,1-2H3,(H,20,24)
InChIKeyKFJTXVVKHQKIQZ-UHFFFAOYSA-N
MW379.38 g/mol
LogP1.52
Rot. Bonds5

About 2,2,2-trifluoro-N-[2-[4-[4-(2-methylpropyl)-2-oxo-1,3-oxazolidin-3-yl]piperidin-1-yl]-2-oxoethyl]acetamide

2,2,2-trifluoro-N-[2-[4-[4-(2-methylpropyl)-2-oxo-1,3-oxazolidin-3-yl]piperidin-1-yl]-2-oxoethyl]acetamide (PubChem CID 3757323) has the molecular formula C16H24F3N3O4 and a molecular weight of 379.38 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-[2-[4-[4-(2-methylpropyl)-2-oxo-1,3-oxazolidin-3-yl]piperidin-1-yl]-2-oxoethyl]acetamide.

Molecular Properties

Compound Name2,2,2-trifluoro-N-[2-[4-[4-(2-methylpropyl)-2-oxo-1,3-oxazolidin-3-yl]piperidin-1-yl]-2-oxoethyl]acetamide
PubChem CID3757323
Molecular FormulaC16H24F3N3O4
Molecular Weight379.38 g/mol
Exact Mass379.17
IUPAC Name2,2,2-trifluoro-N-[2-[4-[4-(2-methylpropyl)-2-oxo-1,3-oxazolidin-3-yl]piperidin-1-yl]-2-oxoethyl]acetamide
SMILESCC(C)CC1COC(=O)N1C1CCN(C(=O)CNC(=O)C(F)(F)F)CC1
InChIInChI=1S/C16H24F3N3O4/c1-10(2)7-12-9-26-15(25)22(12)11-3-5-21(6-4-11)13(23)8-20-14(24)16(17,18)19/h10-12H,3-9H2,1-2H3,(H,20,24)
InChIKeyKFJTXVVKHQKIQZ-UHFFFAOYSA-N
XLogP1.52
TPSA78.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.38
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-N-[2-[4-[4-(2-methylpropyl)-2-oxo-1,3-oxazolidin-3-yl]piperidin-1-yl]-2-oxoethyl]acetamide?
The IUPAC name of 2,2,2-trifluoro-N-[2-[4-[4-(2-methylpropyl)-2-oxo-1,3-oxazolidin-3-yl]piperidin-1-yl]-2-oxoethyl]acetamide (CID 3757323) is 2,2,2-trifluoro-N-[2-[4-[4-(2-methylpropyl)-2-oxo-1,3-oxazolidin-3-yl]piperidin-1-yl]-2-oxoethyl]acetamide.
What is the SMILES notation for 2,2,2-trifluoro-N-[2-[4-[4-(2-methylpropyl)-2-oxo-1,3-oxazolidin-3-yl]piperidin-1-yl]-2-oxoethyl]acetamide?
The canonical SMILES for 2,2,2-trifluoro-N-[2-[4-[4-(2-methylpropyl)-2-oxo-1,3-oxazolidin-3-yl]piperidin-1-yl]-2-oxoethyl]acetamide is CC(C)CC1COC(=O)N1C1CCN(C(=O)CNC(=O)C(F)(F)F)CC1.
What is the InChIKey of 2,2,2-trifluoro-N-[2-[4-[4-(2-methylpropyl)-2-oxo-1,3-oxazolidin-3-yl]piperidin-1-yl]-2-oxoethyl]acetamide?
The InChIKey is KFJTXVVKHQKIQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24F3N3O4/c1-10(2)7-12-9-26-15(25)22(12)11-3-5-21(6-4-11)13(23)8-20-14(24)16(17,18)19/h10-12H,3-9H2,1-2H3,(H,20,24).
What are the key properties of 2,2,2-trifluoro-N-[2-[4-[4-(2-methylpropyl)-2-oxo-1,3-oxazolidin-3-yl]piperidin-1-yl]-2-oxoethyl]acetamide?
2,2,2-trifluoro-N-[2-[4-[4-(2-methylpropyl)-2-oxo-1,3-oxazolidin-3-yl]piperidin-1-yl]-2-oxoethyl]acetamide has a molecular weight of 379.38 g/mol, XLogP of 1.52, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-N-[2-[4-[4-(2-methylpropyl)-2-oxo-1,3-oxazolidin-3-yl]piperidin-1-yl]-2-oxoethyl]acetamide is sourced from PubChem (CID 3757323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).