2,2-bis(2-ethylhexyl)morpholine

C20H41NO — CID 174923684

IUPAC2,2-bis(2-ethylhexyl)morpholine
SMILESCCCCC(CC)CC1(CC(CC)CCCC)CNCCO1
InChIInChI=1S/C20H41NO/c1-5-9-11-18(7-3)15-20(17-21-13-14-22-20)16-19(8-4)12-10-6-2/h18-19,21H,5-17H2,1-4H3
InChIKeyZHZGDEMIRORMTD-UHFFFAOYSA-N
MW311.55 g/mol
LogP5.56
Rot. Bonds12

About 2,2-bis(2-ethylhexyl)morpholine

2,2-bis(2-ethylhexyl)morpholine (PubChem CID 174923684) has the molecular formula C20H41NO and a molecular weight of 311.55 g/mol. Its IUPAC name is 2,2-bis(2-ethylhexyl)morpholine.

Molecular Properties

Compound Name2,2-bis(2-ethylhexyl)morpholine
PubChem CID174923684
Molecular FormulaC20H41NO
Molecular Weight311.55 g/mol
Exact Mass311.32
IUPAC Name2,2-bis(2-ethylhexyl)morpholine
SMILESCCCCC(CC)CC1(CC(CC)CCCC)CNCCO1
InChIInChI=1S/C20H41NO/c1-5-9-11-18(7-3)15-20(17-21-13-14-22-20)16-19(8-4)12-10-6-2/h18-19,21H,5-17H2,1-4H3
InChIKeyZHZGDEMIRORMTD-UHFFFAOYSA-N
XLogP5.56
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500311.55
LogP ≤ 55.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2-bis(2-ethylhexyl)morpholine?
The IUPAC name of 2,2-bis(2-ethylhexyl)morpholine (CID 174923684) is 2,2-bis(2-ethylhexyl)morpholine.
What is the SMILES notation for 2,2-bis(2-ethylhexyl)morpholine?
The canonical SMILES for 2,2-bis(2-ethylhexyl)morpholine is CCCCC(CC)CC1(CC(CC)CCCC)CNCCO1.
What is the InChIKey of 2,2-bis(2-ethylhexyl)morpholine?
The InChIKey is ZHZGDEMIRORMTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H41NO/c1-5-9-11-18(7-3)15-20(17-21-13-14-22-20)16-19(8-4)12-10-6-2/h18-19,21H,5-17H2,1-4H3.
What are the key properties of 2,2-bis(2-ethylhexyl)morpholine?
2,2-bis(2-ethylhexyl)morpholine has a molecular weight of 311.55 g/mol, XLogP of 5.56, 12 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-bis(2-ethylhexyl)morpholine is sourced from PubChem (CID 174923684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).