(4S)-4-amino-2-(methoxymethyl)-1,2-oxazolidin-3-one

C5H10N2O3 — CID 97303131

IUPAC(4S)-4-amino-2-(methoxymethyl)-1,2-oxazolidin-3-one
SMILESCOCN1OC[C@H](N)C1=O
InChIInChI=1S/C5H10N2O3/c1-9-3-7-5(8)4(6)2-10-7/h4H,2-3,6H2,1H3/t4-/m0/s1
InChIKeyNIQRTFYHRCYAJM-BYPYZUCNSA-N
MW146.15 g/mol
LogP-1.31
Rot. Bonds2

About (4S)-4-amino-2-(methoxymethyl)-1,2-oxazolidin-3-one

(4S)-4-amino-2-(methoxymethyl)-1,2-oxazolidin-3-one (PubChem CID 97303131) has the molecular formula C5H10N2O3 and a molecular weight of 146.15 g/mol. Its IUPAC name is (4S)-4-amino-2-(methoxymethyl)-1,2-oxazolidin-3-one.

Molecular Properties

Compound Name(4S)-4-amino-2-(methoxymethyl)-1,2-oxazolidin-3-one
PubChem CID97303131
Molecular FormulaC5H10N2O3
Molecular Weight146.15 g/mol
Exact Mass146.07
IUPAC Name(4S)-4-amino-2-(methoxymethyl)-1,2-oxazolidin-3-one
SMILESCOCN1OC[C@H](N)C1=O
InChIInChI=1S/C5H10N2O3/c1-9-3-7-5(8)4(6)2-10-7/h4H,2-3,6H2,1H3/t4-/m0/s1
InChIKeyNIQRTFYHRCYAJM-BYPYZUCNSA-N
XLogP-1.31
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.15
LogP ≤ 5-1.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (4S)-4-amino-2-(methoxymethyl)-1,2-oxazolidin-3-one?
The IUPAC name of (4S)-4-amino-2-(methoxymethyl)-1,2-oxazolidin-3-one (CID 97303131) is (4S)-4-amino-2-(methoxymethyl)-1,2-oxazolidin-3-one.
What is the SMILES notation for (4S)-4-amino-2-(methoxymethyl)-1,2-oxazolidin-3-one?
The canonical SMILES for (4S)-4-amino-2-(methoxymethyl)-1,2-oxazolidin-3-one is COCN1OC[C@H](N)C1=O.
What is the InChIKey of (4S)-4-amino-2-(methoxymethyl)-1,2-oxazolidin-3-one?
The InChIKey is NIQRTFYHRCYAJM-BYPYZUCNSA-N. The full InChI is InChI=1S/C5H10N2O3/c1-9-3-7-5(8)4(6)2-10-7/h4H,2-3,6H2,1H3/t4-/m0/s1.
What are the key properties of (4S)-4-amino-2-(methoxymethyl)-1,2-oxazolidin-3-one?
(4S)-4-amino-2-(methoxymethyl)-1,2-oxazolidin-3-one has a molecular weight of 146.15 g/mol, XLogP of -1.31, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-4-amino-2-(methoxymethyl)-1,2-oxazolidin-3-one is sourced from PubChem (CID 97303131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).