3-(2,6-diethylphenyl)-1,3-oxazolidin-2-one

C13H17NO2 — CID 14120196

IUPAC3-(2,6-diethylphenyl)-1,3-oxazolidin-2-one
SMILESCCc1cccc(CC)c1N1CCOC1=O
InChIInChI=1S/C13H17NO2/c1-3-10-6-5-7-11(4-2)12(10)14-8-9-16-13(14)15/h5-7H,3-4,8-9H2,1-2H3
InChIKeyGFQDDVNKKJZFFE-UHFFFAOYSA-N
MW219.28 g/mol
LogP2.77
Rot. Bonds3

About 3-(2,6-diethylphenyl)-1,3-oxazolidin-2-one

3-(2,6-diethylphenyl)-1,3-oxazolidin-2-one (PubChem CID 14120196) has the molecular formula C13H17NO2 and a molecular weight of 219.28 g/mol. Its IUPAC name is 3-(2,6-diethylphenyl)-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-(2,6-diethylphenyl)-1,3-oxazolidin-2-one
PubChem CID14120196
Molecular FormulaC13H17NO2
Molecular Weight219.28 g/mol
Exact Mass219.13
IUPAC Name3-(2,6-diethylphenyl)-1,3-oxazolidin-2-one
SMILESCCc1cccc(CC)c1N1CCOC1=O
InChIInChI=1S/C13H17NO2/c1-3-10-6-5-7-11(4-2)12(10)14-8-9-16-13(14)15/h5-7H,3-4,8-9H2,1-2H3
InChIKeyGFQDDVNKKJZFFE-UHFFFAOYSA-N
XLogP2.77
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.28
LogP ≤ 52.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2,6-dichlorophenyl)-1,3-oxazolidin-2-one
CID 14120198
4-(2-ethylphenyl)morpholine-2,3-dione
CID 117005510
1-(2,6-diethylphenyl)imidazolidin-2-one
CID 115370429
3-bromo-1-(2,6-diethylphenyl)pyrrolidin-2-one
CID 63789094
3-[6-(propylsulfanylamino)-2-pyridinyl]-1,3-oxazolidin-2-one
CID 155111241
1-(2,6-diethylphenyl)piperidine
CID 10608826
3-(2-ethyl-6-methylphenyl)-2-oxo-1,3-oxazinane-6-carbonitrile
CID 117010472
2-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]acetaldehyde
CID 57444342
3-[2-(aminomethyl)-4-(trifluoromethyl)phenyl]-1,3-oxazolidin-2-one
CID 112556092
3-(4-phenylphenyl)-1,3-oxazolidin-2-one
CID 102377598
1-(2,6-diethylphenyl)-4-methylpiperazine
CID 58732893
3-[3-[1-(propylamino)ethyl]phenyl]-1,3-oxazolidin-2-one
CID 65295167

Frequently Asked Questions

What is the IUPAC name of 3-(2,6-diethylphenyl)-1,3-oxazolidin-2-one?
The IUPAC name of 3-(2,6-diethylphenyl)-1,3-oxazolidin-2-one (CID 14120196) is 3-(2,6-diethylphenyl)-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-(2,6-diethylphenyl)-1,3-oxazolidin-2-one?
The canonical SMILES for 3-(2,6-diethylphenyl)-1,3-oxazolidin-2-one is CCc1cccc(CC)c1N1CCOC1=O.
What is the InChIKey of 3-(2,6-diethylphenyl)-1,3-oxazolidin-2-one?
The InChIKey is GFQDDVNKKJZFFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO2/c1-3-10-6-5-7-11(4-2)12(10)14-8-9-16-13(14)15/h5-7H,3-4,8-9H2,1-2H3.
What are the key properties of 3-(2,6-diethylphenyl)-1,3-oxazolidin-2-one?
3-(2,6-diethylphenyl)-1,3-oxazolidin-2-one has a molecular weight of 219.28 g/mol, XLogP of 2.77, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,6-diethylphenyl)-1,3-oxazolidin-2-one is sourced from PubChem (CID 14120196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).