3-piperidin-3-yl-1,3-oxazolidin-2-one;hydrochloride

C8H15ClN2O2 — CID 167727849

IUPAC3-piperidin-3-yl-1,3-oxazolidin-2-one;hydrochloride
SMILESCl.O=C1OCCN1C1CCCNC1
InChIInChI=1S/C8H14N2O2.ClH/c11-8-10(4-5-12-8)7-2-1-3-9-6-7;/h7,9H,1-6H2;1H
InChIKeyGNYDUFKAQHHUQI-UHFFFAOYSA-N
MW206.67 g/mol
LogP0.61
Rot. Bonds1

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

3-piperidin-3-yl-1,3-oxazolidin-2-one;hydrochloride (PubChem CID 167727849) has the molecular formula C8H15ClN2O2 and a molecular weight of 206.67 g/mol. Its IUPAC name is 3-piperidin-3-yl-1,3-oxazolidin-2-one;hydrochloride.

Molecular Properties

Compound Name3-piperidin-3-yl-1,3-oxazolidin-2-one;hydrochloride
PubChem CID167727849
Molecular FormulaC8H15ClN2O2
Molecular Weight206.67 g/mol
Exact Mass206.08
IUPAC Name3-piperidin-3-yl-1,3-oxazolidin-2-one;hydrochloride
SMILESCl.O=C1OCCN1C1CCCNC1
InChIInChI=1S/C8H14N2O2.ClH/c11-8-10(4-5-12-8)7-2-1-3-9-6-7;/h7,9H,1-6H2;1H
InChIKeyGNYDUFKAQHHUQI-UHFFFAOYSA-N
XLogP0.61
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.67
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-piperidin-3-yl-1,3-oxazolidin-2-one;hydrochloride?
The IUPAC name of 3-piperidin-3-yl-1,3-oxazolidin-2-one;hydrochloride (CID 167727849) is 3-piperidin-3-yl-1,3-oxazolidin-2-one;hydrochloride.
What is the SMILES notation for 3-piperidin-3-yl-1,3-oxazolidin-2-one;hydrochloride?
The canonical SMILES for 3-piperidin-3-yl-1,3-oxazolidin-2-one;hydrochloride is Cl.O=C1OCCN1C1CCCNC1.
What is the InChIKey of 3-piperidin-3-yl-1,3-oxazolidin-2-one;hydrochloride?
The InChIKey is GNYDUFKAQHHUQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O2.ClH/c11-8-10(4-5-12-8)7-2-1-3-9-6-7;/h7,9H,1-6H2;1H.
What are the key properties of 3-piperidin-3-yl-1,3-oxazolidin-2-one;hydrochloride?
3-piperidin-3-yl-1,3-oxazolidin-2-one;hydrochloride has a molecular weight of 206.67 g/mol, XLogP of 0.61, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperidin-3-yl-1,3-oxazolidin-2-one;hydrochloride is sourced from PubChem (CID 167727849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).