(3S)-2,3-dimethyl-1,2-oxazolidin-5-ol

C5H11NO2 — CID 102318090

IUPAC(3S)-2,3-dimethyl-1,2-oxazolidin-5-ol
SMILESC[C@H]1CC(O)ON1C
InChIInChI=1S/C5H11NO2/c1-4-3-5(7)8-6(4)2/h4-5,7H,3H2,1-2H3/t4-,5?/m0/s1
InChIKeyMUHZLCCYKDESIO-ROLXFIACSA-N
MW117.15 g/mol
LogP-0.04
Rot. Bonds

About (3S)-2,3-dimethyl-1,2-oxazolidin-5-ol

(3S)-2,3-dimethyl-1,2-oxazolidin-5-ol (PubChem CID 102318090) has the molecular formula C5H11NO2 and a molecular weight of 117.15 g/mol. Its IUPAC name is (3S)-2,3-dimethyl-1,2-oxazolidin-5-ol.

Molecular Properties

Compound Name(3S)-2,3-dimethyl-1,2-oxazolidin-5-ol
PubChem CID102318090
Molecular FormulaC5H11NO2
Molecular Weight117.15 g/mol
Exact Mass117.08
IUPAC Name(3S)-2,3-dimethyl-1,2-oxazolidin-5-ol
SMILESC[C@H]1CC(O)ON1C
InChIInChI=1S/C5H11NO2/c1-4-3-5(7)8-6(4)2/h4-5,7H,3H2,1-2H3/t4-,5?/m0/s1
InChIKeyMUHZLCCYKDESIO-ROLXFIACSA-N
XLogP-0.04
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.15
LogP ≤ 5-0.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3S)-2,3-dimethyl-1,2-oxazolidin-5-ol?
The IUPAC name of (3S)-2,3-dimethyl-1,2-oxazolidin-5-ol (CID 102318090) is (3S)-2,3-dimethyl-1,2-oxazolidin-5-ol.
What is the SMILES notation for (3S)-2,3-dimethyl-1,2-oxazolidin-5-ol?
The canonical SMILES for (3S)-2,3-dimethyl-1,2-oxazolidin-5-ol is C[C@H]1CC(O)ON1C.
What is the InChIKey of (3S)-2,3-dimethyl-1,2-oxazolidin-5-ol?
The InChIKey is MUHZLCCYKDESIO-ROLXFIACSA-N. The full InChI is InChI=1S/C5H11NO2/c1-4-3-5(7)8-6(4)2/h4-5,7H,3H2,1-2H3/t4-,5?/m0/s1.
What are the key properties of (3S)-2,3-dimethyl-1,2-oxazolidin-5-ol?
(3S)-2,3-dimethyl-1,2-oxazolidin-5-ol has a molecular weight of 117.15 g/mol, XLogP of -0.04, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-2,3-dimethyl-1,2-oxazolidin-5-ol is sourced from PubChem (CID 102318090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).