(4R)-4-methyl-3-methylsulfonyl-1,3-oxazolidine

C5H11NO3S — CID 59903388

IUPAC(4R)-4-methyl-3-methylsulfonyl-1,3-oxazolidine
SMILESC[C@@H]1COCN1S(C)(=O)=O
InChIInChI=1S/C5H11NO3S/c1-5-3-9-4-6(5)10(2,7)8/h5H,3-4H2,1-2H3/t5-/m1/s1
InChIKeyZOYIDTSUMYLQJQ-RXMQYKEDSA-N
MW165.21 g/mol
LogP-0.38
Rot. Bonds1

About (4R)-4-methyl-3-methylsulfonyl-1,3-oxazolidine

(4R)-4-methyl-3-methylsulfonyl-1,3-oxazolidine (PubChem CID 59903388) has the molecular formula C5H11NO3S and a molecular weight of 165.21 g/mol. Its IUPAC name is (4R)-4-methyl-3-methylsulfonyl-1,3-oxazolidine.

Molecular Properties

Compound Name(4R)-4-methyl-3-methylsulfonyl-1,3-oxazolidine
PubChem CID59903388
Molecular FormulaC5H11NO3S
Molecular Weight165.21 g/mol
Exact Mass165.05
IUPAC Name(4R)-4-methyl-3-methylsulfonyl-1,3-oxazolidine
SMILESC[C@@H]1COCN1S(C)(=O)=O
InChIInChI=1S/C5H11NO3S/c1-5-3-9-4-6(5)10(2,7)8/h5H,3-4H2,1-2H3/t5-/m1/s1
InChIKeyZOYIDTSUMYLQJQ-RXMQYKEDSA-N
XLogP-0.38
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.21
LogP ≤ 5-0.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-Methylsulfonyl-1,3-oxazolidine
CID 56605842
(4S)-4-methyl-3-methylsulfonyl-1,3-oxazolidine
CID 59903391
N-(2-methoxyethyl)-N-propan-2-ylmethanesulfonamide
CID 82953235
3-Ethylsulfonyl-1,3-oxazolidine
CID 110740035
3-(Methoxymethyl)-2-methyl-1,2-thiazolidine 1,1-dioxide
CID 174154351
Ethane;4-methyl-3-methylsulfanyl-1,3-oxazolidine
CID 178146932
N-(1-methoxypropan-2-yl)-N-methylmethanesulfonamide
CID 61059829
N-methyl-N-(oxolan-3-yl)methanesulfonamide
CID 78947760
3-Propylsulfonyl-1,3-oxazolidine
CID 110740036
3-Butylsulfonyl-1,3-oxazolidine
CID 110740037
2-Methyl-3-methylsulfonyl-1,3-oxazolidine
CID 110740217
4,4-Dimethyl-3-methylsulfonyl-1,3-oxazolidine
CID 110740691

Frequently Asked Questions

What is the IUPAC name of (4R)-4-methyl-3-methylsulfonyl-1,3-oxazolidine?
The IUPAC name of (4R)-4-methyl-3-methylsulfonyl-1,3-oxazolidine (CID 59903388) is (4R)-4-methyl-3-methylsulfonyl-1,3-oxazolidine.
What is the SMILES notation for (4R)-4-methyl-3-methylsulfonyl-1,3-oxazolidine?
The canonical SMILES for (4R)-4-methyl-3-methylsulfonyl-1,3-oxazolidine is C[C@@H]1COCN1S(C)(=O)=O.
What is the InChIKey of (4R)-4-methyl-3-methylsulfonyl-1,3-oxazolidine?
The InChIKey is ZOYIDTSUMYLQJQ-RXMQYKEDSA-N. The full InChI is InChI=1S/C5H11NO3S/c1-5-3-9-4-6(5)10(2,7)8/h5H,3-4H2,1-2H3/t5-/m1/s1.
What are the key properties of (4R)-4-methyl-3-methylsulfonyl-1,3-oxazolidine?
(4R)-4-methyl-3-methylsulfonyl-1,3-oxazolidine has a molecular weight of 165.21 g/mol, XLogP of -0.38, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-methyl-3-methylsulfonyl-1,3-oxazolidine is sourced from PubChem (CID 59903388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).