(2R)-1-[(4R)-4-benzyl-2-oxo-1,3-oxazolidin-3-yl]-2-cyclopentylpentane-1,4-dione

C20H25NO4 — CID 59971923

IUPAC(2R)-1-[(4R)-4-benzyl-2-oxo-1,3-oxazolidin-3-yl]-2-cyclopentylpentane-1,4-dione
SMILESCC(=O)C[C@@H](C(=O)N1C(=O)OC[C@H]1Cc1ccccc1)C1CCCC1
InChIInChI=1S/C20H25NO4/c1-14(22)11-18(16-9-5-6-10-16)19(23)21-17(13-25-20(21)24)12-15-7-3-2-4-8-15/h2-4,7-8,16-18H,5-6,9-13H2,1H3/t17-,18-/m1/s1
InChIKeyGLJWSGPFQAUNDI-QZTJIDSGSA-N
MW343.42 g/mol
LogP3.36
Rot. Bonds6

About (2R)-1-[(4R)-4-benzyl-2-oxo-1,3-oxazolidin-3-yl]-2-cyclopentylpentane-1,4-dione

(2R)-1-[(4R)-4-benzyl-2-oxo-1,3-oxazolidin-3-yl]-2-cyclopentylpentane-1,4-dione (PubChem CID 59971923) has the molecular formula C20H25NO4 and a molecular weight of 343.42 g/mol. Its IUPAC name is (2R)-1-[(4R)-4-benzyl-2-oxo-1,3-oxazolidin-3-yl]-2-cyclopentylpentane-1,4-dione.

Molecular Properties

Compound Name(2R)-1-[(4R)-4-benzyl-2-oxo-1,3-oxazolidin-3-yl]-2-cyclopentylpentane-1,4-dione
PubChem CID59971923
Molecular FormulaC20H25NO4
Molecular Weight343.42 g/mol
Exact Mass343.18
IUPAC Name(2R)-1-[(4R)-4-benzyl-2-oxo-1,3-oxazolidin-3-yl]-2-cyclopentylpentane-1,4-dione
SMILESCC(=O)C[C@@H](C(=O)N1C(=O)OC[C@H]1Cc1ccccc1)C1CCCC1
InChIInChI=1S/C20H25NO4/c1-14(22)11-18(16-9-5-6-10-16)19(23)21-17(13-25-20(21)24)12-15-7-3-2-4-8-15/h2-4,7-8,16-18H,5-6,9-13H2,1H3/t17-,18-/m1/s1
InChIKeyGLJWSGPFQAUNDI-QZTJIDSGSA-N
XLogP3.36
TPSA63.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.42
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (2R)-1-[(4R)-4-benzyl-2-oxo-1,3-oxazolidin-3-yl]-2-cyclopentylpentane-1,4-dione with MolForge

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Related Compounds

(2S,3R)-1-[(4S)-4-benzyl-2-oxo-1,3-oxazolidin-3-yl]-2-ethyl-3-hydroxyhexane-1,5-dione
CID 156527029
(2R)-1-[(4R)-4-benzyl-2-oxo-1,3-oxazolidin-3-yl]-2-methylbutane-1,3-dione
CID 102120797
(4S)-3-acetyl-4-benzyl-1,3-oxazolidin-2-one
CID 735929
(4R)-4-benzyl-3-[(2S)-3-fluoro-2-methylpropanoyl]-1,3-oxazolidin-2-one
CID 129274259
(4S)-4-benzyl-3-[(2S)-2-bromo-3-methylbutanoyl]-1,3-oxazolidin-2-one
CID 14604024
4-benzyl-3-(3-bromo-2-methylpropanoyl)-1,3-oxazolidin-2-one
CID 76787138
(4R)-4-benzyl-3-[(2S)-2,3,3-trimethylbutanoyl]-1,3-oxazolidin-2-one
CID 118941522
1-(4-benzyl-2-oxo-1,3-oxazolidin-3-yl)-2-(2-methylpropyl)butane-1,3-dione
CID 22894172
4-benzyl-3-[(2R)-2-(4-phenylcyclohexyl)propanoyl]-1,3-oxazolidin-2-one
CID 71156180
4-benzyl-3-[(2S)-2-ethyl-3-methylbutanoyl]-1,3-oxazolidin-2-one
CID 175760920
(4R)-4-benzyl-3-[(2S)-2-benzyl-3-methylbutanoyl]-1,3-oxazolidin-2-one
CID 10545886
3-benzyl-4-(4-benzyl-2-oxo-1,3-oxazolidin-3-yl)-4-oxobutanoic acid
CID 22397352

Frequently Asked Questions

What is the IUPAC name of (2R)-1-[(4R)-4-benzyl-2-oxo-1,3-oxazolidin-3-yl]-2-cyclopentylpentane-1,4-dione?
The IUPAC name of (2R)-1-[(4R)-4-benzyl-2-oxo-1,3-oxazolidin-3-yl]-2-cyclopentylpentane-1,4-dione (CID 59971923) is (2R)-1-[(4R)-4-benzyl-2-oxo-1,3-oxazolidin-3-yl]-2-cyclopentylpentane-1,4-dione.
What is the SMILES notation for (2R)-1-[(4R)-4-benzyl-2-oxo-1,3-oxazolidin-3-yl]-2-cyclopentylpentane-1,4-dione?
The canonical SMILES for (2R)-1-[(4R)-4-benzyl-2-oxo-1,3-oxazolidin-3-yl]-2-cyclopentylpentane-1,4-dione is CC(=O)C[C@@H](C(=O)N1C(=O)OC[C@H]1Cc1ccccc1)C1CCCC1.
What is the InChIKey of (2R)-1-[(4R)-4-benzyl-2-oxo-1,3-oxazolidin-3-yl]-2-cyclopentylpentane-1,4-dione?
The InChIKey is GLJWSGPFQAUNDI-QZTJIDSGSA-N. The full InChI is InChI=1S/C20H25NO4/c1-14(22)11-18(16-9-5-6-10-16)19(23)21-17(13-25-20(21)24)12-15-7-3-2-4-8-15/h2-4,7-8,16-18H,5-6,9-13H2,1H3/t17-,18-/m1/s1.
What are the key properties of (2R)-1-[(4R)-4-benzyl-2-oxo-1,3-oxazolidin-3-yl]-2-cyclopentylpentane-1,4-dione?
(2R)-1-[(4R)-4-benzyl-2-oxo-1,3-oxazolidin-3-yl]-2-cyclopentylpentane-1,4-dione has a molecular weight of 343.42 g/mol, XLogP of 3.36, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[(4R)-4-benzyl-2-oxo-1,3-oxazolidin-3-yl]-2-cyclopentylpentane-1,4-dione is sourced from PubChem (CID 59971923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).