(4R)-4-benzyl-3-methyl-1,3-oxazolidin-2-ol

C11H15NO2 — CID 170024227

IUPAC(4R)-4-benzyl-3-methyl-1,3-oxazolidin-2-ol
SMILESCN1C(O)OC[C@H]1Cc1ccccc1
InChIInChI=1S/C11H15NO2/c1-12-10(8-14-11(12)13)7-9-5-3-2-4-6-9/h2-6,10-11,13H,7-8H2,1H3/t10-,11?/m1/s1
InChIKeyDWILDMNZKOLRBK-NFJWQWPMSA-N
MW193.25 g/mol
LogP0.84
Rot. Bonds2

About (4R)-4-benzyl-3-methyl-1,3-oxazolidin-2-ol

(4R)-4-benzyl-3-methyl-1,3-oxazolidin-2-ol (PubChem CID 170024227) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is (4R)-4-benzyl-3-methyl-1,3-oxazolidin-2-ol.

Molecular Properties

Compound Name(4R)-4-benzyl-3-methyl-1,3-oxazolidin-2-ol
PubChem CID170024227
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Name(4R)-4-benzyl-3-methyl-1,3-oxazolidin-2-ol
SMILESCN1C(O)OC[C@H]1Cc1ccccc1
InChIInChI=1S/C11H15NO2/c1-12-10(8-14-11(12)13)7-9-5-3-2-4-6-9/h2-6,10-11,13H,7-8H2,1H3/t10-,11?/m1/s1
InChIKeyDWILDMNZKOLRBK-NFJWQWPMSA-N
XLogP0.84
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4R)-4-benzyl-3-methyl-1,3-oxazolidin-2-ol?
The IUPAC name of (4R)-4-benzyl-3-methyl-1,3-oxazolidin-2-ol (CID 170024227) is (4R)-4-benzyl-3-methyl-1,3-oxazolidin-2-ol.
What is the SMILES notation for (4R)-4-benzyl-3-methyl-1,3-oxazolidin-2-ol?
The canonical SMILES for (4R)-4-benzyl-3-methyl-1,3-oxazolidin-2-ol is CN1C(O)OC[C@H]1Cc1ccccc1.
What is the InChIKey of (4R)-4-benzyl-3-methyl-1,3-oxazolidin-2-ol?
The InChIKey is DWILDMNZKOLRBK-NFJWQWPMSA-N. The full InChI is InChI=1S/C11H15NO2/c1-12-10(8-14-11(12)13)7-9-5-3-2-4-6-9/h2-6,10-11,13H,7-8H2,1H3/t10-,11?/m1/s1.
What are the key properties of (4R)-4-benzyl-3-methyl-1,3-oxazolidin-2-ol?
(4R)-4-benzyl-3-methyl-1,3-oxazolidin-2-ol has a molecular weight of 193.25 g/mol, XLogP of 0.84, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-benzyl-3-methyl-1,3-oxazolidin-2-ol is sourced from PubChem (CID 170024227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).