2,2-bis[2-(2-morpholin-4-ylethoxy)-4-pyridinyl]ethanamine

C24H35N5O4 — CID 70127525

IUPAC2,2-bis[2-(2-morpholin-4-ylethoxy)-4-pyridinyl]ethanamine
SMILESNCC(c1ccnc(OCCN2CCOCC2)c1)c1ccnc(OCCN2CCOCC2)c1
InChIInChI=1S/C24H35N5O4/c25-19-22(20-1-3-26-23(17-20)32-15-9-28-5-11-30-12-6-28)21-2-4-27-24(18-21)33-16-10-29-7-13-31-14-8-29/h1-4,17-18,22H,5-16,19,25H2
InChIKeyPRPQLZMWGYELGV-UHFFFAOYSA-N
MW457.58 g/mol
LogP0.99
Rot. Bonds11

About 2,2-bis[2-(2-morpholin-4-ylethoxy)-4-pyridinyl]ethanamine

2,2-bis[2-(2-morpholin-4-ylethoxy)-4-pyridinyl]ethanamine (PubChem CID 70127525) has the molecular formula C24H35N5O4 and a molecular weight of 457.58 g/mol. Its IUPAC name is 2,2-bis[2-(2-morpholin-4-ylethoxy)-4-pyridinyl]ethanamine.

Molecular Properties

Compound Name2,2-bis[2-(2-morpholin-4-ylethoxy)-4-pyridinyl]ethanamine
PubChem CID70127525
Molecular FormulaC24H35N5O4
Molecular Weight457.58 g/mol
Exact Mass457.27
IUPAC Name2,2-bis[2-(2-morpholin-4-ylethoxy)-4-pyridinyl]ethanamine
SMILESNCC(c1ccnc(OCCN2CCOCC2)c1)c1ccnc(OCCN2CCOCC2)c1
InChIInChI=1S/C24H35N5O4/c25-19-22(20-1-3-26-23(17-20)32-15-9-28-5-11-30-12-6-28)21-2-4-27-24(18-21)33-16-10-29-7-13-31-14-8-29/h1-4,17-18,22H,5-16,19,25H2
InChIKeyPRPQLZMWGYELGV-UHFFFAOYSA-N
XLogP0.99
TPSA95.20 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds11
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500457.58
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

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Frequently Asked Questions

What is the IUPAC name of 2,2-bis[2-(2-morpholin-4-ylethoxy)-4-pyridinyl]ethanamine?
The IUPAC name of 2,2-bis[2-(2-morpholin-4-ylethoxy)-4-pyridinyl]ethanamine (CID 70127525) is 2,2-bis[2-(2-morpholin-4-ylethoxy)-4-pyridinyl]ethanamine.
What is the SMILES notation for 2,2-bis[2-(2-morpholin-4-ylethoxy)-4-pyridinyl]ethanamine?
The canonical SMILES for 2,2-bis[2-(2-morpholin-4-ylethoxy)-4-pyridinyl]ethanamine is NCC(c1ccnc(OCCN2CCOCC2)c1)c1ccnc(OCCN2CCOCC2)c1.
What is the InChIKey of 2,2-bis[2-(2-morpholin-4-ylethoxy)-4-pyridinyl]ethanamine?
The InChIKey is PRPQLZMWGYELGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H35N5O4/c25-19-22(20-1-3-26-23(17-20)32-15-9-28-5-11-30-12-6-28)21-2-4-27-24(18-21)33-16-10-29-7-13-31-14-8-29/h1-4,17-18,22H,5-16,19,25H2.
What are the key properties of 2,2-bis[2-(2-morpholin-4-ylethoxy)-4-pyridinyl]ethanamine?
2,2-bis[2-(2-morpholin-4-ylethoxy)-4-pyridinyl]ethanamine has a molecular weight of 457.58 g/mol, XLogP of 0.99, 11 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-bis[2-(2-morpholin-4-ylethoxy)-4-pyridinyl]ethanamine is sourced from PubChem (CID 70127525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).