N,N-bis[2-(2-ethylmorpholin-4-yl)ethyl]-2-morpholin-4-ylethanamine

C22H44N4O3 — CID 19989287

IUPACN,N-bis[2-(2-ethylmorpholin-4-yl)ethyl]-2-morpholin-4-ylethanamine
SMILESCCC1CN(CCN(CCN2CCOCC2)CCN2CCOC(CC)C2)CCO1
InChIInChI=1S/C22H44N4O3/c1-3-21-19-25(13-17-28-21)9-7-23(5-6-24-11-15-27-16-12-24)8-10-26-14-18-29-22(4-2)20-26/h21-22H,3-20H2,1-2H3
InChIKeyLDYXVAANRSKKOK-UHFFFAOYSA-N
MW412.62 g/mol
LogP0.84
Rot. Bonds11

About N,N-bis[2-(2-ethylmorpholin-4-yl)ethyl]-2-morpholin-4-ylethanamine

N,N-bis[2-(2-ethylmorpholin-4-yl)ethyl]-2-morpholin-4-ylethanamine (PubChem CID 19989287) has the molecular formula C22H44N4O3 and a molecular weight of 412.62 g/mol. Its IUPAC name is N,N-bis[2-(2-ethylmorpholin-4-yl)ethyl]-2-morpholin-4-ylethanamine.

Molecular Properties

Compound NameN,N-bis[2-(2-ethylmorpholin-4-yl)ethyl]-2-morpholin-4-ylethanamine
PubChem CID19989287
Molecular FormulaC22H44N4O3
Molecular Weight412.62 g/mol
Exact Mass412.34
IUPAC NameN,N-bis[2-(2-ethylmorpholin-4-yl)ethyl]-2-morpholin-4-ylethanamine
SMILESCCC1CN(CCN(CCN2CCOCC2)CCN2CCOC(CC)C2)CCO1
InChIInChI=1S/C22H44N4O3/c1-3-21-19-25(13-17-28-21)9-7-23(5-6-24-11-15-27-16-12-24)8-10-26-14-18-29-22(4-2)20-26/h21-22H,3-20H2,1-2H3
InChIKeyLDYXVAANRSKKOK-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,N-bis[2-(2-ethylmorpholin-4-yl)ethyl]-2-morpholin-4-ylethanamine?
The IUPAC name of N,N-bis[2-(2-ethylmorpholin-4-yl)ethyl]-2-morpholin-4-ylethanamine (CID 19989287) is N,N-bis[2-(2-ethylmorpholin-4-yl)ethyl]-2-morpholin-4-ylethanamine.
What is the SMILES notation for N,N-bis[2-(2-ethylmorpholin-4-yl)ethyl]-2-morpholin-4-ylethanamine?
The canonical SMILES for N,N-bis[2-(2-ethylmorpholin-4-yl)ethyl]-2-morpholin-4-ylethanamine is CCC1CN(CCN(CCN2CCOCC2)CCN2CCOC(CC)C2)CCO1.
What is the InChIKey of N,N-bis[2-(2-ethylmorpholin-4-yl)ethyl]-2-morpholin-4-ylethanamine?
The InChIKey is LDYXVAANRSKKOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H44N4O3/c1-3-21-19-25(13-17-28-21)9-7-23(5-6-24-11-15-27-16-12-24)8-10-26-14-18-29-22(4-2)20-26/h21-22H,3-20H2,1-2H3.
What are the key properties of N,N-bis[2-(2-ethylmorpholin-4-yl)ethyl]-2-morpholin-4-ylethanamine?
N,N-bis[2-(2-ethylmorpholin-4-yl)ethyl]-2-morpholin-4-ylethanamine 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,N-bis[2-(2-ethylmorpholin-4-yl)ethyl]-2-morpholin-4-ylethanamine is sourced from PubChem (CID 19989287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).