Ethane;N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylpropanamide

C₁₁H₂₂N₂O₃ — CID 153395469

About Ethane;N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylpropanamide

Ethane;N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylpropanamide (PubChem CID 153395469) has the molecular formula C₁₁H₂₂N₂O₃ and a molecular weight of 230.31 g/mol. Its IUPAC name is ethane;N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylpropanamide.

Molecular Properties

• Compound Name: Ethane;N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylpropanamide
• PubChem CID: 153395469
• Molecular Formula: C₁₁H₂₂N₂O₃
• Molecular Weight: 230.31 g/mol
• Exact Mass: 230.16
• IUPAC Name: ethane;N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylpropanamide
• SMILES: CC.CCN1OC[C@@H](NC(=O)C(C)C)C1=O
• InChI: InChI=1S/C9H16N2O3.C2H6/c1-4-11-9(13)7(5-14-11)10-8(12)6(2)3;1-2/h6-7H,4-5H2,1-3H3,(H,10,12);1-2H3/t7-;/m1./s1
• InChIKey: ATZWPDLHSSOFLV-OGFXRTJISA-N
• XLogP: 0.95
• TPSA: 58.64 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 3
• Rotatable Bonds: 3
• Heavy Atoms: 16
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	230.31
LogP ≤ 5	0.95
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of Ethane;N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylpropanamide?

The IUPAC name of Ethane;N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylpropanamide (CID 153395469) is ethane;N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylpropanamide.

What is the SMILES notation for Ethane;N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylpropanamide?

The canonical SMILES for Ethane;N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylpropanamide is CC.CCN1OC[C@@H](NC(=O)C(C)C)C1=O.

What is the InChIKey of Ethane;N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylpropanamide?

The InChIKey is ATZWPDLHSSOFLV-OGFXRTJISA-N. The full InChI is InChI=1S/C9H16N2O3.C2H6/c1-4-11-9(13)7(5-14-11)10-8(12)6(2)3;1-2/h6-7H,4-5H2,1-3H3,(H,10,12);1-2H3/t7-;/m1./s1.

What are the key properties of Ethane;N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylpropanamide?

Ethane;N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylpropanamide has a molecular weight of 230.31 g/mol, XLogP of 0.95, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for Ethane;N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylpropanamide is sourced from PubChem (CID 153395469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 153395469 — identifiers, structure, computed properties (public domain)

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