2-ethyl-4-[2-[1-(2-ethylmorpholin-4-yl)-2-morpholin-4-ylpropan-2-yl]oxy-2-morpholin-4-ylpropyl]morpholine

C26H50N4O5 — CID 70019533

IUPAC2-ethyl-4-[2-[1-(2-ethylmorpholin-4-yl)-2-morpholin-4-ylpropan-2-yl]oxy-2-morpholin-4-ylpropyl]morpholine
SMILESCCC1CN(CC(C)(OC(C)(CN2CCOC(CC)C2)N2CCOCC2)N2CCOCC2)CCO1
InChIInChI=1S/C26H50N4O5/c1-5-23-19-27(7-17-33-23)21-25(3,29-9-13-31-14-10-29)35-26(4,30-11-15-32-16-12-30)22-28-8-18-34-24(6-2)20-28/h23-24H,5-22H2,1-4H3
InChIKeyBUVIHFTZFNBQOZ-UHFFFAOYSA-N
MW498.71 g/mol
LogP1.32
Rot. Bonds10

About 2-ethyl-4-[2-[1-(2-ethylmorpholin-4-yl)-2-morpholin-4-ylpropan-2-yl]oxy-2-morpholin-4-ylpropyl]morpholine

2-ethyl-4-[2-[1-(2-ethylmorpholin-4-yl)-2-morpholin-4-ylpropan-2-yl]oxy-2-morpholin-4-ylpropyl]morpholine (PubChem CID 70019533) has the molecular formula C26H50N4O5 and a molecular weight of 498.71 g/mol. Its IUPAC name is 2-ethyl-4-[2-[1-(2-ethylmorpholin-4-yl)-2-morpholin-4-ylpropan-2-yl]oxy-2-morpholin-4-ylpropyl]morpholine.

Molecular Properties

Compound Name2-ethyl-4-[2-[1-(2-ethylmorpholin-4-yl)-2-morpholin-4-ylpropan-2-yl]oxy-2-morpholin-4-ylpropyl]morpholine
PubChem CID70019533
Molecular FormulaC26H50N4O5
Molecular Weight498.71 g/mol
Exact Mass498.38
IUPAC Name2-ethyl-4-[2-[1-(2-ethylmorpholin-4-yl)-2-morpholin-4-ylpropan-2-yl]oxy-2-morpholin-4-ylpropyl]morpholine
SMILESCCC1CN(CC(C)(OC(C)(CN2CCOC(CC)C2)N2CCOCC2)N2CCOCC2)CCO1
InChIInChI=1S/C26H50N4O5/c1-5-23-19-27(7-17-33-23)21-25(3,29-9-13-31-14-10-29)35-26(4,30-11-15-32-16-12-30)22-28-8-18-34-24(6-2)20-28/h23-24H,5-22H2,1-4H3
InChIKeyBUVIHFTZFNBQOZ-UHFFFAOYSA-N
XLogP1.32
TPSA59.11 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds10
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500498.71
LogP ≤ 51.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-4-[2-[1-(2-ethylmorpholin-4-yl)-2-morpholin-4-ylpropan-2-yl]oxy-2-morpholin-4-ylpropyl]morpholine?
The IUPAC name of 2-ethyl-4-[2-[1-(2-ethylmorpholin-4-yl)-2-morpholin-4-ylpropan-2-yl]oxy-2-morpholin-4-ylpropyl]morpholine (CID 70019533) is 2-ethyl-4-[2-[1-(2-ethylmorpholin-4-yl)-2-morpholin-4-ylpropan-2-yl]oxy-2-morpholin-4-ylpropyl]morpholine.
What is the SMILES notation for 2-ethyl-4-[2-[1-(2-ethylmorpholin-4-yl)-2-morpholin-4-ylpropan-2-yl]oxy-2-morpholin-4-ylpropyl]morpholine?
The canonical SMILES for 2-ethyl-4-[2-[1-(2-ethylmorpholin-4-yl)-2-morpholin-4-ylpropan-2-yl]oxy-2-morpholin-4-ylpropyl]morpholine is CCC1CN(CC(C)(OC(C)(CN2CCOC(CC)C2)N2CCOCC2)N2CCOCC2)CCO1.
What is the InChIKey of 2-ethyl-4-[2-[1-(2-ethylmorpholin-4-yl)-2-morpholin-4-ylpropan-2-yl]oxy-2-morpholin-4-ylpropyl]morpholine?
The InChIKey is BUVIHFTZFNBQOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H50N4O5/c1-5-23-19-27(7-17-33-23)21-25(3,29-9-13-31-14-10-29)35-26(4,30-11-15-32-16-12-30)22-28-8-18-34-24(6-2)20-28/h23-24H,5-22H2,1-4H3.
What are the key properties of 2-ethyl-4-[2-[1-(2-ethylmorpholin-4-yl)-2-morpholin-4-ylpropan-2-yl]oxy-2-morpholin-4-ylpropyl]morpholine?
2-ethyl-4-[2-[1-(2-ethylmorpholin-4-yl)-2-morpholin-4-ylpropan-2-yl]oxy-2-morpholin-4-ylpropyl]morpholine has a molecular weight of 498.71 g/mol, XLogP of 1.32, 10 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4-[2-[1-(2-ethylmorpholin-4-yl)-2-morpholin-4-ylpropan-2-yl]oxy-2-morpholin-4-ylpropyl]morpholine is sourced from PubChem (CID 70019533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).