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

C11H13NO2 — CID 14836208

IUPAC(4R)-4-benzyl-3-methyl-1,3-oxazolidin-2-one
SMILESCN1C(=O)OC[C@H]1Cc1ccccc1
InChIInChI=1S/C11H13NO2/c1-12-10(8-14-11(12)13)7-9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3/t10-/m1/s1
InChIKeyCAXLCRGKHDWKRY-SNVBAGLBSA-N
MW191.23 g/mol
LogP1.68
Rot. Bonds2

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

(4R)-4-benzyl-3-methyl-1,3-oxazolidin-2-one (PubChem CID 14836208) has the molecular formula C11H13NO2 and a molecular weight of 191.23 g/mol. Its IUPAC name is (4R)-4-benzyl-3-methyl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name(4R)-4-benzyl-3-methyl-1,3-oxazolidin-2-one
PubChem CID14836208
Molecular FormulaC11H13NO2
Molecular Weight191.23 g/mol
Exact Mass191.09
IUPAC Name(4R)-4-benzyl-3-methyl-1,3-oxazolidin-2-one
SMILESCN1C(=O)OC[C@H]1Cc1ccccc1
InChIInChI=1S/C11H13NO2/c1-12-10(8-14-11(12)13)7-9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3/t10-/m1/s1
InChIKeyCAXLCRGKHDWKRY-SNVBAGLBSA-N
XLogP1.68
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(4S)-4-benzyl-3-propyl-1,3-oxazolidin-2-one
CID 155294169
(4S)-3-acetyl-4-benzyl-1,3-oxazolidin-2-one
CID 735929
(2R)-2-(3-aminopropyl)butanedioic acid;(4R)-4-benzyl-3-methyl-1,3-oxazolidin-2-one
CID 70051407
(4R)-4-benzyl-2-oxo-1,3-oxazolidine-3-carbaldehyde
CID 10774601
3-methyl-4-(pyridin-2-ylmethyl)-1,3-oxazolidin-2-one
CID 19987344
(4R)-4-benzyl-3-[(E)-1-hydroxyprop-1-enyl]-1,3-oxazolidin-2-one
CID 100990536
4-benzyl-3-(1-phenylethyl)-1,3-oxazolidin-2-one
CID 68997353
(4R)-4-benzyl-3-(1-sulfanylethyl)-1,3-oxazolidin-2-one
CID 170024134
(4S)-4-benzyl-3-tert-butylsulfanyl-1,3-oxazolidin-2-one
CID 15668312
(4S)-4-benzyl-3-[(1S)-1-sulfanylethyl]-1,3-oxazolidin-2-one
CID 139924962
(4R)-4-benzyl-3-[(1R)-1-sulfanylethyl]-1,3-oxazolidin-2-one
CID 139924961
(4S)-4-benzyl-3-hexadecyl-1,3-oxazolidin-2-one
CID 150010367

Frequently Asked Questions

What is the IUPAC name of (4R)-4-benzyl-3-methyl-1,3-oxazolidin-2-one?
The IUPAC name of (4R)-4-benzyl-3-methyl-1,3-oxazolidin-2-one (CID 14836208) is (4R)-4-benzyl-3-methyl-1,3-oxazolidin-2-one.
What is the SMILES notation for (4R)-4-benzyl-3-methyl-1,3-oxazolidin-2-one?
The canonical SMILES for (4R)-4-benzyl-3-methyl-1,3-oxazolidin-2-one is CN1C(=O)OC[C@H]1Cc1ccccc1.
What is the InChIKey of (4R)-4-benzyl-3-methyl-1,3-oxazolidin-2-one?
The InChIKey is CAXLCRGKHDWKRY-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H13NO2/c1-12-10(8-14-11(12)13)7-9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3/t10-/m1/s1.
What are the key properties of (4R)-4-benzyl-3-methyl-1,3-oxazolidin-2-one?
(4R)-4-benzyl-3-methyl-1,3-oxazolidin-2-one has a molecular weight of 191.23 g/mol, XLogP of 1.68, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-benzyl-3-methyl-1,3-oxazolidin-2-one is sourced from PubChem (CID 14836208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).