3-[2-(methylamino)ethyl]-1,3-oxazolidin-2-one;hydrochloride

C6H13ClN2O2 — CID 71756423

IUPAC3-[2-(methylamino)ethyl]-1,3-oxazolidin-2-one;hydrochloride
SMILESCNCCN1CCOC1=O.Cl
InChIInChI=1S/C6H12N2O2.ClH/c1-7-2-3-8-4-5-10-6(8)9;/h7H,2-5H2,1H3;1H
InChIKeyWFHNFLOIOYXRKA-UHFFFAOYSA-N
MW180.63 g/mol
LogP0.08
Rot. Bonds3

About 3-[2-(methylamino)ethyl]-1,3-oxazolidin-2-one;hydrochloride

3-[2-(methylamino)ethyl]-1,3-oxazolidin-2-one;hydrochloride (PubChem CID 71756423) has the molecular formula C6H13ClN2O2 and a molecular weight of 180.63 g/mol. Its IUPAC name is 3-[2-(methylamino)ethyl]-1,3-oxazolidin-2-one;hydrochloride.

Molecular Properties

Compound Name3-[2-(methylamino)ethyl]-1,3-oxazolidin-2-one;hydrochloride
PubChem CID71756423
Molecular FormulaC6H13ClN2O2
Molecular Weight180.63 g/mol
Exact Mass180.07
IUPAC Name3-[2-(methylamino)ethyl]-1,3-oxazolidin-2-one;hydrochloride
SMILESCNCCN1CCOC1=O.Cl
InChIInChI=1S/C6H12N2O2.ClH/c1-7-2-3-8-4-5-10-6(8)9;/h7H,2-5H2,1H3;1H
InChIKeyWFHNFLOIOYXRKA-UHFFFAOYSA-N
XLogP0.08
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.63
LogP ≤ 50.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[2-(methylamino)ethyl]-1,3-oxazolidin-2-one;hydrochloride?
The IUPAC name of 3-[2-(methylamino)ethyl]-1,3-oxazolidin-2-one;hydrochloride (CID 71756423) is 3-[2-(methylamino)ethyl]-1,3-oxazolidin-2-one;hydrochloride.
What is the SMILES notation for 3-[2-(methylamino)ethyl]-1,3-oxazolidin-2-one;hydrochloride?
The canonical SMILES for 3-[2-(methylamino)ethyl]-1,3-oxazolidin-2-one;hydrochloride is CNCCN1CCOC1=O.Cl.
What is the InChIKey of 3-[2-(methylamino)ethyl]-1,3-oxazolidin-2-one;hydrochloride?
The InChIKey is WFHNFLOIOYXRKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O2.ClH/c1-7-2-3-8-4-5-10-6(8)9;/h7H,2-5H2,1H3;1H.
What are the key properties of 3-[2-(methylamino)ethyl]-1,3-oxazolidin-2-one;hydrochloride?
3-[2-(methylamino)ethyl]-1,3-oxazolidin-2-one;hydrochloride has a molecular weight of 180.63 g/mol, XLogP of 0.08, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(methylamino)ethyl]-1,3-oxazolidin-2-one;hydrochloride is sourced from PubChem (CID 71756423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).