N-[2-(2,6-diethylmorpholin-4-yl)ethyl]-2-morpholin-4-yl-N-(2-morpholin-4-ylethyl)ethanamine

C22H44N4O3 — CID 19989277

IUPACN-[2-(2,6-diethylmorpholin-4-yl)ethyl]-2-morpholin-4-yl-N-(2-morpholin-4-ylethyl)ethanamine
SMILESCCC1CN(CCN(CCN2CCOCC2)CCN2CCOCC2)CC(CC)O1
InChIInChI=1S/C22H44N4O3/c1-3-21-19-26(20-22(4-2)29-21)10-9-23(5-7-24-11-15-27-16-12-24)6-8-25-13-17-28-18-14-25/h21-22H,3-20H2,1-2H3
InChIKeyHDHWZYQUARVKNR-UHFFFAOYSA-N
MW412.62 g/mol
LogP0.84
Rot. Bonds11

About N-[2-(2,6-diethylmorpholin-4-yl)ethyl]-2-morpholin-4-yl-N-(2-morpholin-4-ylethyl)ethanamine

N-[2-(2,6-diethylmorpholin-4-yl)ethyl]-2-morpholin-4-yl-N-(2-morpholin-4-ylethyl)ethanamine (PubChem CID 19989277) has the molecular formula C22H44N4O3 and a molecular weight of 412.62 g/mol. Its IUPAC name is N-[2-(2,6-diethylmorpholin-4-yl)ethyl]-2-morpholin-4-yl-N-(2-morpholin-4-ylethyl)ethanamine.

Molecular Properties

Compound NameN-[2-(2,6-diethylmorpholin-4-yl)ethyl]-2-morpholin-4-yl-N-(2-morpholin-4-ylethyl)ethanamine
PubChem CID19989277
Molecular FormulaC22H44N4O3
Molecular Weight412.62 g/mol
Exact Mass412.34
IUPAC NameN-[2-(2,6-diethylmorpholin-4-yl)ethyl]-2-morpholin-4-yl-N-(2-morpholin-4-ylethyl)ethanamine
SMILESCCC1CN(CCN(CCN2CCOCC2)CCN2CCOCC2)CC(CC)O1
InChIInChI=1S/C22H44N4O3/c1-3-21-19-26(20-22(4-2)29-21)10-9-23(5-7-24-11-15-27-16-12-24)6-8-25-13-17-28-18-14-25/h21-22H,3-20H2,1-2H3
InChIKeyHDHWZYQUARVKNR-UHFFFAOYSA-N
XLogP0.84
TPSA40.65 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds11
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.62
LogP ≤ 50.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2,6-diethylmorpholin-4-yl)ethyl]-2-morpholin-4-yl-N-(2-morpholin-4-ylethyl)ethanamine?
The IUPAC name of N-[2-(2,6-diethylmorpholin-4-yl)ethyl]-2-morpholin-4-yl-N-(2-morpholin-4-ylethyl)ethanamine (CID 19989277) is N-[2-(2,6-diethylmorpholin-4-yl)ethyl]-2-morpholin-4-yl-N-(2-morpholin-4-ylethyl)ethanamine.
What is the SMILES notation for N-[2-(2,6-diethylmorpholin-4-yl)ethyl]-2-morpholin-4-yl-N-(2-morpholin-4-ylethyl)ethanamine?
The canonical SMILES for N-[2-(2,6-diethylmorpholin-4-yl)ethyl]-2-morpholin-4-yl-N-(2-morpholin-4-ylethyl)ethanamine is CCC1CN(CCN(CCN2CCOCC2)CCN2CCOCC2)CC(CC)O1.
What is the InChIKey of N-[2-(2,6-diethylmorpholin-4-yl)ethyl]-2-morpholin-4-yl-N-(2-morpholin-4-ylethyl)ethanamine?
The InChIKey is HDHWZYQUARVKNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H44N4O3/c1-3-21-19-26(20-22(4-2)29-21)10-9-23(5-7-24-11-15-27-16-12-24)6-8-25-13-17-28-18-14-25/h21-22H,3-20H2,1-2H3.
What are the key properties of N-[2-(2,6-diethylmorpholin-4-yl)ethyl]-2-morpholin-4-yl-N-(2-morpholin-4-ylethyl)ethanamine?
N-[2-(2,6-diethylmorpholin-4-yl)ethyl]-2-morpholin-4-yl-N-(2-morpholin-4-ylethyl)ethanamine has a molecular weight of 412.62 g/mol, XLogP of 0.84, 11 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,6-diethylmorpholin-4-yl)ethyl]-2-morpholin-4-yl-N-(2-morpholin-4-ylethyl)ethanamine is sourced from PubChem (CID 19989277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).