1,3-oxazolidin-2-one;hydrochloride

C3H6ClNO2 — CID 19037880

IUPAC1,3-oxazolidin-2-one;hydrochloride
SMILESCl.O=C1NCCO1
InChIInChI=1S/C3H5NO2.ClH/c5-3-4-1-2-6-3;/h1-2H2,(H,4,5);1H
InChIKeyUQSOHAMZCUBZQH-UHFFFAOYSA-N
MW123.54 g/mol
LogP0.15
Rot. Bonds

About 1,3-oxazolidin-2-one;hydrochloride

1,3-oxazolidin-2-one;hydrochloride (PubChem CID 19037880) has the molecular formula C3H6ClNO2 and a molecular weight of 123.54 g/mol. Its IUPAC name is 1,3-oxazolidin-2-one;hydrochloride.

Molecular Properties

Compound Name1,3-oxazolidin-2-one;hydrochloride
PubChem CID19037880
Molecular FormulaC3H6ClNO2
Molecular Weight123.54 g/mol
Exact Mass123.01
IUPAC Name1,3-oxazolidin-2-one;hydrochloride
SMILESCl.O=C1NCCO1
InChIInChI=1S/C3H5NO2.ClH/c5-3-4-1-2-6-3;/h1-2H2,(H,4,5);1H
InChIKeyUQSOHAMZCUBZQH-UHFFFAOYSA-N
XLogP0.15
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.54
LogP ≤ 50.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,3-oxazolidin-2-one;hydrochloride?
The IUPAC name of 1,3-oxazolidin-2-one;hydrochloride (CID 19037880) is 1,3-oxazolidin-2-one;hydrochloride.
What is the SMILES notation for 1,3-oxazolidin-2-one;hydrochloride?
The canonical SMILES for 1,3-oxazolidin-2-one;hydrochloride is Cl.O=C1NCCO1.
What is the InChIKey of 1,3-oxazolidin-2-one;hydrochloride?
The InChIKey is UQSOHAMZCUBZQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H5NO2.ClH/c5-3-4-1-2-6-3;/h1-2H2,(H,4,5);1H.
What are the key properties of 1,3-oxazolidin-2-one;hydrochloride?
1,3-oxazolidin-2-one;hydrochloride has a molecular weight of 123.54 g/mol, XLogP of 0.15, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-oxazolidin-2-one;hydrochloride is sourced from PubChem (CID 19037880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).