4-amino-1,3-oxazolidin-2-one

C3H6N2O2 — CID 18941532

IUPAC4-amino-1,3-oxazolidin-2-one
SMILESNC1COC(=O)N1
InChIInChI=1S/C3H6N2O2/c4-2-1-7-3(6)5-2/h2H,1,4H2,(H,5,6)
InChIKeyWITJRSWBSNUSPF-UHFFFAOYSA-N
MW102.09 g/mol
LogP-0.99
Rot. Bonds

About 4-amino-1,3-oxazolidin-2-one

4-amino-1,3-oxazolidin-2-one (PubChem CID 18941532) has the molecular formula C3H6N2O2 and a molecular weight of 102.09 g/mol. Its IUPAC name is 4-amino-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name4-amino-1,3-oxazolidin-2-one
PubChem CID18941532
Molecular FormulaC3H6N2O2
Molecular Weight102.09 g/mol
Exact Mass102.04
IUPAC Name4-amino-1,3-oxazolidin-2-one
SMILESNC1COC(=O)N1
InChIInChI=1S/C3H6N2O2/c4-2-1-7-3(6)5-2/h2H,1,4H2,(H,5,6)
InChIKeyWITJRSWBSNUSPF-UHFFFAOYSA-N
XLogP-0.99
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500102.09
LogP ≤ 5-0.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-amino-1,3-oxazolidin-2-one?
The IUPAC name of 4-amino-1,3-oxazolidin-2-one (CID 18941532) is 4-amino-1,3-oxazolidin-2-one.
What is the SMILES notation for 4-amino-1,3-oxazolidin-2-one?
The canonical SMILES for 4-amino-1,3-oxazolidin-2-one is NC1COC(=O)N1.
What is the InChIKey of 4-amino-1,3-oxazolidin-2-one?
The InChIKey is WITJRSWBSNUSPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6N2O2/c4-2-1-7-3(6)5-2/h2H,1,4H2,(H,5,6).
What are the key properties of 4-amino-1,3-oxazolidin-2-one?
4-amino-1,3-oxazolidin-2-one has a molecular weight of 102.09 g/mol, XLogP of -0.99, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1,3-oxazolidin-2-one is sourced from PubChem (CID 18941532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).