4-(3-ethylpentan-3-yl)morpholine

C11H23NO — CID 15939277

IUPAC4-(3-ethylpentan-3-yl)morpholine
SMILESCCC(CC)(CC)N1CCOCC1
InChIInChI=1S/C11H23NO/c1-4-11(5-2,6-3)12-7-9-13-10-8-12/h4-10H2,1-3H3
InChIKeyLSEXURRMQBHTOH-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.29
Rot. Bonds4

About 4-(3-ethylpentan-3-yl)morpholine

4-(3-ethylpentan-3-yl)morpholine (PubChem CID 15939277) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 4-(3-ethylpentan-3-yl)morpholine.

Molecular Properties

Compound Name4-(3-ethylpentan-3-yl)morpholine
PubChem CID15939277
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name4-(3-ethylpentan-3-yl)morpholine
SMILESCCC(CC)(CC)N1CCOCC1
InChIInChI=1S/C11H23NO/c1-4-11(5-2,6-3)12-7-9-13-10-8-12/h4-10H2,1-3H3
InChIKeyLSEXURRMQBHTOH-UHFFFAOYSA-N
XLogP2.29
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(3-ethylpentan-3-yl)morpholine?
The IUPAC name of 4-(3-ethylpentan-3-yl)morpholine (CID 15939277) is 4-(3-ethylpentan-3-yl)morpholine.
What is the SMILES notation for 4-(3-ethylpentan-3-yl)morpholine?
The canonical SMILES for 4-(3-ethylpentan-3-yl)morpholine is CCC(CC)(CC)N1CCOCC1.
What is the InChIKey of 4-(3-ethylpentan-3-yl)morpholine?
The InChIKey is LSEXURRMQBHTOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-4-11(5-2,6-3)12-7-9-13-10-8-12/h4-10H2,1-3H3.
What are the key properties of 4-(3-ethylpentan-3-yl)morpholine?
4-(3-ethylpentan-3-yl)morpholine has a molecular weight of 185.31 g/mol, XLogP of 2.29, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-ethylpentan-3-yl)morpholine is sourced from PubChem (CID 15939277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).