5-hydroxy-3,5-dimethyl-1,3-oxazolidin-2-one

C5H9NO3 — CID 166457859

IUPAC5-hydroxy-3,5-dimethyl-1,3-oxazolidin-2-one
SMILESCN1CC(C)(O)OC1=O
InChIInChI=1S/C5H9NO3/c1-5(8)3-6(2)4(7)9-5/h8H,3H2,1-2H3
InChIKeyRCGPSJVYUXEDJQ-UHFFFAOYSA-N
MW131.13 g/mol
LogP-0.22
Rot. Bonds

About 5-hydroxy-3,5-dimethyl-1,3-oxazolidin-2-one

5-hydroxy-3,5-dimethyl-1,3-oxazolidin-2-one (PubChem CID 166457859) has the molecular formula C5H9NO3 and a molecular weight of 131.13 g/mol. Its IUPAC name is 5-hydroxy-3,5-dimethyl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name5-hydroxy-3,5-dimethyl-1,3-oxazolidin-2-one
PubChem CID166457859
Molecular FormulaC5H9NO3
Molecular Weight131.13 g/mol
Exact Mass131.06
IUPAC Name5-hydroxy-3,5-dimethyl-1,3-oxazolidin-2-one
SMILESCN1CC(C)(O)OC1=O
InChIInChI=1S/C5H9NO3/c1-5(8)3-6(2)4(7)9-5/h8H,3H2,1-2H3
InChIKeyRCGPSJVYUXEDJQ-UHFFFAOYSA-N
XLogP-0.22
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.13
LogP ≤ 5-0.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(chloromethyl)-3,5-dimethyl-1,3-oxazolidin-2-one
CID 123845918
5-(3-aminopropyl)-3,5-dimethyl-1,3-oxazolidin-2-one
CID 115065232
3-methylspiro[1,3-oxazolidine-5,2'-bicyclo[2.2.1]heptane]-2-one
CID 11564569
5-(2-aminophenyl)-3,5-dimethyl-1,3-oxazolidin-2-one
CID 105458735
(5S)-3,5-dimethyl-5-[(3S)-piperidin-3-yl]-1,3-oxazolidin-2-one
CID 171842990
3,9-dimethyl-1-oxa-3,9-diazaspiro[5.5]undecan-2-one
CID 159740354
5-(5-chloro-2-methoxyphenyl)-3,5-dimethyl-1,3-oxazolidin-2-one
CID 82088842
tert-butyl 3-methyl-2-oxo-1-oxa-3,7-diazaspiro[4.4]nonane-7-carboxylate
CID 176720221
5-(2,4-dimethoxyphenyl)-3,5-dimethyl-1,3-oxazolidin-2-one
CID 82087623
5-hydroxy-3-methyl-1,3-oxazolidin-2-one
CID 67762404
(5R)-5-hydroxy-3-methyl-1,3-oxazolidin-2-one
CID 70341446
(4R)-4-hydroxy-3,4,7,7,9,9-hexamethyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one
CID 674434

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-3,5-dimethyl-1,3-oxazolidin-2-one?
The IUPAC name of 5-hydroxy-3,5-dimethyl-1,3-oxazolidin-2-one (CID 166457859) is 5-hydroxy-3,5-dimethyl-1,3-oxazolidin-2-one.
What is the SMILES notation for 5-hydroxy-3,5-dimethyl-1,3-oxazolidin-2-one?
The canonical SMILES for 5-hydroxy-3,5-dimethyl-1,3-oxazolidin-2-one is CN1CC(C)(O)OC1=O.
What is the InChIKey of 5-hydroxy-3,5-dimethyl-1,3-oxazolidin-2-one?
The InChIKey is RCGPSJVYUXEDJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9NO3/c1-5(8)3-6(2)4(7)9-5/h8H,3H2,1-2H3.
What are the key properties of 5-hydroxy-3,5-dimethyl-1,3-oxazolidin-2-one?
5-hydroxy-3,5-dimethyl-1,3-oxazolidin-2-one has a molecular weight of 131.13 g/mol, XLogP of -0.22, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-3,5-dimethyl-1,3-oxazolidin-2-one is sourced from PubChem (CID 166457859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).