[(4S)-4-hydroxy-1,2-oxazolidin-2-yl]-[(2S)-oxolan-2-yl]methanone

C8H13NO4 — CID 130522568

IUPAC[(4S)-4-hydroxy-1,2-oxazolidin-2-yl]-[(2S)-oxolan-2-yl]methanone
SMILESO=C([C@@H]1CCCO1)N1C[C@H](O)CO1
InChIInChI=1S/C8H13NO4/c10-6-4-9(13-5-6)8(11)7-2-1-3-12-7/h6-7,10H,1-5H2/t6-,7-/m0/s1
InChIKeyTYGQSCZXSAUZSC-BQBZGAKWSA-N
MW187.19 g/mol
LogP-0.70
Rot. Bonds1

About [(4S)-4-hydroxy-1,2-oxazolidin-2-yl]-[(2S)-oxolan-2-yl]methanone

[(4S)-4-hydroxy-1,2-oxazolidin-2-yl]-[(2S)-oxolan-2-yl]methanone (PubChem CID 130522568) has the molecular formula C8H13NO4 and a molecular weight of 187.19 g/mol. Its IUPAC name is [(4S)-4-hydroxy-1,2-oxazolidin-2-yl]-[(2S)-oxolan-2-yl]methanone.

Molecular Properties

Compound Name[(4S)-4-hydroxy-1,2-oxazolidin-2-yl]-[(2S)-oxolan-2-yl]methanone
PubChem CID130522568
Molecular FormulaC8H13NO4
Molecular Weight187.19 g/mol
Exact Mass187.08
IUPAC Name[(4S)-4-hydroxy-1,2-oxazolidin-2-yl]-[(2S)-oxolan-2-yl]methanone
SMILESO=C([C@@H]1CCCO1)N1C[C@H](O)CO1
InChIInChI=1S/C8H13NO4/c10-6-4-9(13-5-6)8(11)7-2-1-3-12-7/h6-7,10H,1-5H2/t6-,7-/m0/s1
InChIKeyTYGQSCZXSAUZSC-BQBZGAKWSA-N
XLogP-0.70
TPSA59.00 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.19
LogP ≤ 5-0.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[(4S)-4-hydroxy-1,2-oxazolidin-2-yl]-(oxan-2-yl)methanone
CID 130522566
(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)-[(2S)-oxolan-2-yl]methanone
CID 103873635
(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)-[(2R)-oxolan-2-yl]methanone
CID 103850249
(3,4-dihydroxypyrrolidin-1-yl)-(oxan-2-yl)methanone
CID 106671015
[(3R,4S)-3,4-dihydroxypyrrolidin-1-yl]-(oxan-2-yl)methanone
CID 79403349
1-[(2S)-oxolane-2-carbonyl]azetidine-3-carboxylic acid
CID 104855720
[(3R)-3-methylpyrrolidin-1-yl]-[(2R)-oxolan-2-yl]methanone
CID 143794584
(3,5-dimethylmorpholin-4-yl)-(oxolan-2-yl)methanone
CID 71683933
[(3R)-3-(hydroxymethyl)piperidin-1-yl]-[(2R)-oxolan-2-yl]methanone
CID 39243248
(3,5-dimethylpiperazin-1-yl)-[(2S)-oxolan-2-yl]methanone
CID 104856276
(3,5-dimethylpiperazin-1-yl)-(oxolan-2-yl)methanone
CID 63863884
[(3R)-3-aminopyrrolidin-1-yl]-[(2R)-oxolan-2-yl]methanone
CID 94339947

Frequently Asked Questions

What is the IUPAC name of [(4S)-4-hydroxy-1,2-oxazolidin-2-yl]-[(2S)-oxolan-2-yl]methanone?
The IUPAC name of [(4S)-4-hydroxy-1,2-oxazolidin-2-yl]-[(2S)-oxolan-2-yl]methanone (CID 130522568) is [(4S)-4-hydroxy-1,2-oxazolidin-2-yl]-[(2S)-oxolan-2-yl]methanone.
What is the SMILES notation for [(4S)-4-hydroxy-1,2-oxazolidin-2-yl]-[(2S)-oxolan-2-yl]methanone?
The canonical SMILES for [(4S)-4-hydroxy-1,2-oxazolidin-2-yl]-[(2S)-oxolan-2-yl]methanone is O=C([C@@H]1CCCO1)N1C[C@H](O)CO1.
What is the InChIKey of [(4S)-4-hydroxy-1,2-oxazolidin-2-yl]-[(2S)-oxolan-2-yl]methanone?
The InChIKey is TYGQSCZXSAUZSC-BQBZGAKWSA-N. The full InChI is InChI=1S/C8H13NO4/c10-6-4-9(13-5-6)8(11)7-2-1-3-12-7/h6-7,10H,1-5H2/t6-,7-/m0/s1.
What are the key properties of [(4S)-4-hydroxy-1,2-oxazolidin-2-yl]-[(2S)-oxolan-2-yl]methanone?
[(4S)-4-hydroxy-1,2-oxazolidin-2-yl]-[(2S)-oxolan-2-yl]methanone has a molecular weight of 187.19 g/mol, XLogP of -0.70, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(4S)-4-hydroxy-1,2-oxazolidin-2-yl]-[(2S)-oxolan-2-yl]methanone is sourced from PubChem (CID 130522568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).