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

C10H12N2O2 — CID 11229292

IUPAC(4R)-3-amino-4-benzyl-1,3-oxazolidin-2-one
SMILESNN1C(=O)OC[C@H]1Cc1ccccc1
InChIInChI=1S/C10H12N2O2/c11-12-9(7-14-10(12)13)6-8-4-2-1-3-5-8/h1-5,9H,6-7,11H2/t9-/m1/s1
InChIKeyVGOMGOOWGTZCRK-SECBINFHSA-N
MW192.22 g/mol
LogP0.92
Rot. Bonds2

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

(4R)-3-amino-4-benzyl-1,3-oxazolidin-2-one (PubChem CID 11229292) has the molecular formula C10H12N2O2 and a molecular weight of 192.22 g/mol. Its IUPAC name is (4R)-3-amino-4-benzyl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name(4R)-3-amino-4-benzyl-1,3-oxazolidin-2-one
PubChem CID11229292
Molecular FormulaC10H12N2O2
Molecular Weight192.22 g/mol
Exact Mass192.09
IUPAC Name(4R)-3-amino-4-benzyl-1,3-oxazolidin-2-one
SMILESNN1C(=O)OC[C@H]1Cc1ccccc1
InChIInChI=1S/C10H12N2O2/c11-12-9(7-14-10(12)13)6-8-4-2-1-3-5-8/h1-5,9H,6-7,11H2/t9-/m1/s1
InChIKeyVGOMGOOWGTZCRK-SECBINFHSA-N
XLogP0.92
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}

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Related Compounds

(R)-4-Benzyl-2-oxazolidinone
CID 2734969
(S)-(+)-3-Acetyl-4-benzyl-2-oxazolidinone
CID 735929
(S)-4-Benzyl-2-oxazolidinone
CID 736225
(4S)-4-Benzyl-3-propanoyl-1,3-oxazolidin-2-one
CID 2733696
4-Benzyl-3-methylsulfanyl-1,3-oxazolidin-2-one
CID 11992672
(R)-(-)-4-Benzyl-3-propionyl-2-oxazolidinone
CID 10966403
4-Benzyl-1,3-oxazolidin-2-one
CID 559668
4-Benzyl-3-propanoyl-1,3-oxazolidin-2-one
CID 4050249
(S)-4-Benzyl-3-(pent-4-enoyl)oxazolidin-2-one
CID 10491506
(R)-4-Benzyl-3-pent-4-enoyloxazolidin-2-one
CID 10858190
(4S)-4-[(1S)-1-fluoro-1-phenylethyl]-1,3-oxazolidin-2-one
CID 139043414
(4S)-4-[(R)-fluoro(phenyl)methyl]-1,3-oxazolidin-2-one
CID 176439046

Frequently Asked Questions

What is the IUPAC name of (4R)-3-amino-4-benzyl-1,3-oxazolidin-2-one?
The IUPAC name of (4R)-3-amino-4-benzyl-1,3-oxazolidin-2-one (CID 11229292) is (4R)-3-amino-4-benzyl-1,3-oxazolidin-2-one.
What is the SMILES notation for (4R)-3-amino-4-benzyl-1,3-oxazolidin-2-one?
The canonical SMILES for (4R)-3-amino-4-benzyl-1,3-oxazolidin-2-one is NN1C(=O)OC[C@H]1Cc1ccccc1.
What is the InChIKey of (4R)-3-amino-4-benzyl-1,3-oxazolidin-2-one?
The InChIKey is VGOMGOOWGTZCRK-SECBINFHSA-N. The full InChI is InChI=1S/C10H12N2O2/c11-12-9(7-14-10(12)13)6-8-4-2-1-3-5-8/h1-5,9H,6-7,11H2/t9-/m1/s1.
What are the key properties of (4R)-3-amino-4-benzyl-1,3-oxazolidin-2-one?
(4R)-3-amino-4-benzyl-1,3-oxazolidin-2-one has a molecular weight of 192.22 g/mol, XLogP of 0.92, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-3-amino-4-benzyl-1,3-oxazolidin-2-one is sourced from PubChem (CID 11229292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).