ethyl 2-morpholin-4-ylacetate;hydrochloride

C8H16ClNO3 — CID 45264830

IUPACethyl 2-morpholin-4-ylacetate;hydrochloride
SMILESCCOC(=O)CN1CCOCC1.Cl
InChIInChI=1S/C8H15NO3.ClH/c1-2-12-8(10)7-9-3-5-11-6-4-9;/h2-7H2,1H3;1H
InChIKeyYKCOPXALXFASAJ-UHFFFAOYSA-N
MW209.67 g/mol
LogP0.30
Rot. Bonds3

About ethyl 2-morpholin-4-ylacetate;hydrochloride

ethyl 2-morpholin-4-ylacetate;hydrochloride (PubChem CID 45264830) has the molecular formula C8H16ClNO3 and a molecular weight of 209.67 g/mol. Its IUPAC name is ethyl 2-morpholin-4-ylacetate;hydrochloride.

Molecular Properties

Compound Nameethyl 2-morpholin-4-ylacetate;hydrochloride
PubChem CID45264830
Molecular FormulaC8H16ClNO3
Molecular Weight209.67 g/mol
Exact Mass209.08
IUPAC Nameethyl 2-morpholin-4-ylacetate;hydrochloride
SMILESCCOC(=O)CN1CCOCC1.Cl
InChIInChI=1S/C8H15NO3.ClH/c1-2-12-8(10)7-9-3-5-11-6-4-9;/h2-7H2,1H3;1H
InChIKeyYKCOPXALXFASAJ-UHFFFAOYSA-N
XLogP0.30
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.67
LogP ≤ 50.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of ethyl 2-morpholin-4-ylacetate;hydrochloride?
The IUPAC name of ethyl 2-morpholin-4-ylacetate;hydrochloride (CID 45264830) is ethyl 2-morpholin-4-ylacetate;hydrochloride.
What is the SMILES notation for ethyl 2-morpholin-4-ylacetate;hydrochloride?
The canonical SMILES for ethyl 2-morpholin-4-ylacetate;hydrochloride is CCOC(=O)CN1CCOCC1.Cl.
What is the InChIKey of ethyl 2-morpholin-4-ylacetate;hydrochloride?
The InChIKey is YKCOPXALXFASAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO3.ClH/c1-2-12-8(10)7-9-3-5-11-6-4-9;/h2-7H2,1H3;1H.
What are the key properties of ethyl 2-morpholin-4-ylacetate;hydrochloride?
ethyl 2-morpholin-4-ylacetate;hydrochloride has a molecular weight of 209.67 g/mol, XLogP of 0.30, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-morpholin-4-ylacetate;hydrochloride is sourced from PubChem (CID 45264830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).