1-(2,2-dimethyl-1,3-oxazolidin-3-yl)ethanone

C7H13NO2 — CID 3014341

IUPAC1-(2,2-dimethyl-1,3-oxazolidin-3-yl)ethanone
SMILESCC(=O)N1CCOC1(C)C
InChIInChI=1S/C7H13NO2/c1-6(9)8-4-5-10-7(8,2)3/h4-5H2,1-3H3
InChIKeyHZALDJBABLPFBT-UHFFFAOYSA-N
MW143.19 g/mol
LogP0.60
Rot. Bonds

About 1-(2,2-dimethyl-1,3-oxazolidin-3-yl)ethanone

1-(2,2-dimethyl-1,3-oxazolidin-3-yl)ethanone (PubChem CID 3014341) has the molecular formula C7H13NO2 and a molecular weight of 143.19 g/mol. Its IUPAC name is 1-(2,2-dimethyl-1,3-oxazolidin-3-yl)ethanone.

Molecular Properties

Compound Name1-(2,2-dimethyl-1,3-oxazolidin-3-yl)ethanone
PubChem CID3014341
Molecular FormulaC7H13NO2
Molecular Weight143.19 g/mol
Exact Mass143.09
IUPAC Name1-(2,2-dimethyl-1,3-oxazolidin-3-yl)ethanone
SMILESCC(=O)N1CCOC1(C)C
InChIInChI=1S/C7H13NO2/c1-6(9)8-4-5-10-7(8,2)3/h4-5H2,1-3H3
InChIKeyHZALDJBABLPFBT-UHFFFAOYSA-N
XLogP0.60
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 50.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2,2-dimethyl-1,3-oxazolidin-3-yl)ethanone?
The IUPAC name of 1-(2,2-dimethyl-1,3-oxazolidin-3-yl)ethanone (CID 3014341) is 1-(2,2-dimethyl-1,3-oxazolidin-3-yl)ethanone.
What is the SMILES notation for 1-(2,2-dimethyl-1,3-oxazolidin-3-yl)ethanone?
The canonical SMILES for 1-(2,2-dimethyl-1,3-oxazolidin-3-yl)ethanone is CC(=O)N1CCOC1(C)C.
What is the InChIKey of 1-(2,2-dimethyl-1,3-oxazolidin-3-yl)ethanone?
The InChIKey is HZALDJBABLPFBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO2/c1-6(9)8-4-5-10-7(8,2)3/h4-5H2,1-3H3.
What are the key properties of 1-(2,2-dimethyl-1,3-oxazolidin-3-yl)ethanone?
1-(2,2-dimethyl-1,3-oxazolidin-3-yl)ethanone has a molecular weight of 143.19 g/mol, XLogP of 0.60, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-dimethyl-1,3-oxazolidin-3-yl)ethanone is sourced from PubChem (CID 3014341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).