2-hydroxyethyl 5-ethyl-2-methylmorpholine-4-carboxylate

C10H19NO4 — CID 79345232

IUPAC2-hydroxyethyl 5-ethyl-2-methylmorpholine-4-carboxylate
SMILESCCC1COC(C)CN1C(=O)OCCO
InChIInChI=1S/C10H19NO4/c1-3-9-7-15-8(2)6-11(9)10(13)14-5-4-12/h8-9,12H,3-7H2,1-2H3
InChIKeyNHFWCSONXMUXFR-UHFFFAOYSA-N
MW217.26 g/mol
LogP0.61
Rot. Bonds3

About 2-hydroxyethyl 5-ethyl-2-methylmorpholine-4-carboxylate

2-hydroxyethyl 5-ethyl-2-methylmorpholine-4-carboxylate (PubChem CID 79345232) has the molecular formula C10H19NO4 and a molecular weight of 217.26 g/mol. Its IUPAC name is 2-hydroxyethyl 5-ethyl-2-methylmorpholine-4-carboxylate.

Molecular Properties

Compound Name2-hydroxyethyl 5-ethyl-2-methylmorpholine-4-carboxylate
PubChem CID79345232
Molecular FormulaC10H19NO4
Molecular Weight217.26 g/mol
Exact Mass217.13
IUPAC Name2-hydroxyethyl 5-ethyl-2-methylmorpholine-4-carboxylate
SMILESCCC1COC(C)CN1C(=O)OCCO
InChIInChI=1S/C10H19NO4/c1-3-9-7-15-8(2)6-11(9)10(13)14-5-4-12/h8-9,12H,3-7H2,1-2H3
InChIKeyNHFWCSONXMUXFR-UHFFFAOYSA-N
XLogP0.61
TPSA59.00 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.26
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxyethyl 5-ethyl-2-methylmorpholine-4-carboxylate?
The IUPAC name of 2-hydroxyethyl 5-ethyl-2-methylmorpholine-4-carboxylate (CID 79345232) is 2-hydroxyethyl 5-ethyl-2-methylmorpholine-4-carboxylate.
What is the SMILES notation for 2-hydroxyethyl 5-ethyl-2-methylmorpholine-4-carboxylate?
The canonical SMILES for 2-hydroxyethyl 5-ethyl-2-methylmorpholine-4-carboxylate is CCC1COC(C)CN1C(=O)OCCO.
What is the InChIKey of 2-hydroxyethyl 5-ethyl-2-methylmorpholine-4-carboxylate?
The InChIKey is NHFWCSONXMUXFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO4/c1-3-9-7-15-8(2)6-11(9)10(13)14-5-4-12/h8-9,12H,3-7H2,1-2H3.
What are the key properties of 2-hydroxyethyl 5-ethyl-2-methylmorpholine-4-carboxylate?
2-hydroxyethyl 5-ethyl-2-methylmorpholine-4-carboxylate has a molecular weight of 217.26 g/mol, XLogP of 0.61, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxyethyl 5-ethyl-2-methylmorpholine-4-carboxylate is sourced from PubChem (CID 79345232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).