N,N-bis[2-(2,6-diethylmorpholin-4-yl)ethyl]-2-morpholin-4-ylethanamine

C26H52N4O3 — CID 19989283

IUPACN,N-bis[2-(2,6-diethylmorpholin-4-yl)ethyl]-2-morpholin-4-ylethanamine
SMILESCCC1CN(CCN(CCN2CCOCC2)CCN2CC(CC)OC(CC)C2)CC(CC)O1
InChIInChI=1S/C26H52N4O3/c1-5-23-19-29(20-24(6-2)32-23)13-11-27(9-10-28-15-17-31-18-16-28)12-14-30-21-25(7-3)33-26(8-4)22-30/h23-26H,5-22H2,1-4H3
InChIKeyPRYKCBFVHMLFPF-UHFFFAOYSA-N
MW468.73 g/mol
LogP2.40
Rot. Bonds13

About N,N-bis[2-(2,6-diethylmorpholin-4-yl)ethyl]-2-morpholin-4-ylethanamine

N,N-bis[2-(2,6-diethylmorpholin-4-yl)ethyl]-2-morpholin-4-ylethanamine (PubChem CID 19989283) has the molecular formula C26H52N4O3 and a molecular weight of 468.73 g/mol. Its IUPAC name is N,N-bis[2-(2,6-diethylmorpholin-4-yl)ethyl]-2-morpholin-4-ylethanamine.

Molecular Properties

Compound NameN,N-bis[2-(2,6-diethylmorpholin-4-yl)ethyl]-2-morpholin-4-ylethanamine
PubChem CID19989283
Molecular FormulaC26H52N4O3
Molecular Weight468.73 g/mol
Exact Mass468.40
IUPAC NameN,N-bis[2-(2,6-diethylmorpholin-4-yl)ethyl]-2-morpholin-4-ylethanamine
SMILESCCC1CN(CCN(CCN2CCOCC2)CCN2CC(CC)OC(CC)C2)CC(CC)O1
InChIInChI=1S/C26H52N4O3/c1-5-23-19-29(20-24(6-2)32-23)13-11-27(9-10-28-15-17-31-18-16-28)12-14-30-21-25(7-3)33-26(8-4)22-30/h23-26H,5-22H2,1-4H3
InChIKeyPRYKCBFVHMLFPF-UHFFFAOYSA-N
XLogP2.40
TPSA40.65 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds13
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500468.73
LogP ≤ 52.40
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-(2,6-diethylmorpholin-4-yl)ethyl]-2-morpholin-4-ylethanamine?
The IUPAC name of N,N-bis[2-(2,6-diethylmorpholin-4-yl)ethyl]-2-morpholin-4-ylethanamine (CID 19989283) is N,N-bis[2-(2,6-diethylmorpholin-4-yl)ethyl]-2-morpholin-4-ylethanamine.
What is the SMILES notation for N,N-bis[2-(2,6-diethylmorpholin-4-yl)ethyl]-2-morpholin-4-ylethanamine?
The canonical SMILES for N,N-bis[2-(2,6-diethylmorpholin-4-yl)ethyl]-2-morpholin-4-ylethanamine is CCC1CN(CCN(CCN2CCOCC2)CCN2CC(CC)OC(CC)C2)CC(CC)O1.
What is the InChIKey of N,N-bis[2-(2,6-diethylmorpholin-4-yl)ethyl]-2-morpholin-4-ylethanamine?
The InChIKey is PRYKCBFVHMLFPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H52N4O3/c1-5-23-19-29(20-24(6-2)32-23)13-11-27(9-10-28-15-17-31-18-16-28)12-14-30-21-25(7-3)33-26(8-4)22-30/h23-26H,5-22H2,1-4H3.
What are the key properties of N,N-bis[2-(2,6-diethylmorpholin-4-yl)ethyl]-2-morpholin-4-ylethanamine?
N,N-bis[2-(2,6-diethylmorpholin-4-yl)ethyl]-2-morpholin-4-ylethanamine has a molecular weight of 468.73 g/mol, XLogP of 2.40, 13 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis[2-(2,6-diethylmorpholin-4-yl)ethyl]-2-morpholin-4-ylethanamine is sourced from PubChem (CID 19989283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).