(4S)-2,4-dimethyl-1,2-oxazolidin-5-ol

C5H11NO2 — CID 102318093

IUPAC(4S)-2,4-dimethyl-1,2-oxazolidin-5-ol
SMILESC[C@H]1CN(C)OC1O
InChIInChI=1S/C5H11NO2/c1-4-3-6(2)8-5(4)7/h4-5,7H,3H2,1-2H3/t4-,5?/m0/s1
InChIKeyDAHOQENOOIIWSC-ROLXFIACSA-N
MW117.15 g/mol
LogP-0.18
Rot. Bonds

About (4S)-2,4-dimethyl-1,2-oxazolidin-5-ol

(4S)-2,4-dimethyl-1,2-oxazolidin-5-ol (PubChem CID 102318093) has the molecular formula C5H11NO2 and a molecular weight of 117.15 g/mol. Its IUPAC name is (4S)-2,4-dimethyl-1,2-oxazolidin-5-ol.

Molecular Properties

Compound Name(4S)-2,4-dimethyl-1,2-oxazolidin-5-ol
PubChem CID102318093
Molecular FormulaC5H11NO2
Molecular Weight117.15 g/mol
Exact Mass117.08
IUPAC Name(4S)-2,4-dimethyl-1,2-oxazolidin-5-ol
SMILESC[C@H]1CN(C)OC1O
InChIInChI=1S/C5H11NO2/c1-4-3-6(2)8-5(4)7/h4-5,7H,3H2,1-2H3/t4-,5?/m0/s1
InChIKeyDAHOQENOOIIWSC-ROLXFIACSA-N
XLogP-0.18
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 ≤ 5-0.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,4-Dimethyl-1,2-oxazolidin-5-ol
CID 130128675
2,3-Dimethyl-1,2-oxazolidin-5-ol
CID 130128676
(3S,4S)-2,3,4-trimethyl-1,2-oxazolidin-5-ol
CID 130757547
2,2-Dimethyl-1,2-oxazolidin-2-ium-5-ol chloride
CID 15357014
2-Tert-butyl-1,2-oxazolidin-5-ol
CID 13542187
2,4-Dimethyl-1,2-oxazolidin-3-ol;ethane
CID 142359357
(5S)-2-tert-butyl-1,2-oxazolidin-5-ol
CID 172097570
(5R)-2-tert-butyl-1,2-oxazolidin-5-ol
CID 172097700
3-[Hydroxy(propyl)amino]propane-1,1-diol
CID 174693876
3-[Ethyl(hydroxy)amino]propane-1,1-diol
CID 175013714
2,2-Dimethyl-1,2-oxazolidin-2-ium-5-ol
CID 15357015
(3S)-2,3-dimethyl-1,2-oxazolidin-5-ol
CID 102318090

Frequently Asked Questions

What is the IUPAC name of (4S)-2,4-dimethyl-1,2-oxazolidin-5-ol?
The IUPAC name of (4S)-2,4-dimethyl-1,2-oxazolidin-5-ol (CID 102318093) is (4S)-2,4-dimethyl-1,2-oxazolidin-5-ol.
What is the SMILES notation for (4S)-2,4-dimethyl-1,2-oxazolidin-5-ol?
The canonical SMILES for (4S)-2,4-dimethyl-1,2-oxazolidin-5-ol is C[C@H]1CN(C)OC1O.
What is the InChIKey of (4S)-2,4-dimethyl-1,2-oxazolidin-5-ol?
The InChIKey is DAHOQENOOIIWSC-ROLXFIACSA-N. The full InChI is InChI=1S/C5H11NO2/c1-4-3-6(2)8-5(4)7/h4-5,7H,3H2,1-2H3/t4-,5?/m0/s1.
What are the key properties of (4S)-2,4-dimethyl-1,2-oxazolidin-5-ol?
(4S)-2,4-dimethyl-1,2-oxazolidin-5-ol has a molecular weight of 117.15 g/mol, XLogP of -0.18, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-2,4-dimethyl-1,2-oxazolidin-5-ol is sourced from PubChem (CID 102318093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).