4-(2-methylhexyl)morpholine

C11H23NO — CID 102491214

IUPAC4-(2-methylhexyl)morpholine
SMILESCCCCC(C)CN1CCOCC1
InChIInChI=1S/C11H23NO/c1-3-4-5-11(2)10-12-6-8-13-9-7-12/h11H,3-10H2,1-2H3
InChIKeyGFTMEISTJYOVTI-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.14
Rot. Bonds5

About 4-(2-methylhexyl)morpholine

4-(2-methylhexyl)morpholine (PubChem CID 102491214) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 4-(2-methylhexyl)morpholine.

Molecular Properties

Compound Name4-(2-methylhexyl)morpholine
PubChem CID102491214
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name4-(2-methylhexyl)morpholine
SMILESCCCCC(C)CN1CCOCC1
InChIInChI=1S/C11H23NO/c1-3-4-5-11(2)10-12-6-8-13-9-7-12/h11H,3-10H2,1-2H3
InChIKeyGFTMEISTJYOVTI-UHFFFAOYSA-N
XLogP2.14
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(2-methylhexyl)morpholine?
The IUPAC name of 4-(2-methylhexyl)morpholine (CID 102491214) is 4-(2-methylhexyl)morpholine.
What is the SMILES notation for 4-(2-methylhexyl)morpholine?
The canonical SMILES for 4-(2-methylhexyl)morpholine is CCCCC(C)CN1CCOCC1.
What is the InChIKey of 4-(2-methylhexyl)morpholine?
The InChIKey is GFTMEISTJYOVTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-3-4-5-11(2)10-12-6-8-13-9-7-12/h11H,3-10H2,1-2H3.
What are the key properties of 4-(2-methylhexyl)morpholine?
4-(2-methylhexyl)morpholine has a molecular weight of 185.31 g/mol, XLogP of 2.14, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylhexyl)morpholine is sourced from PubChem (CID 102491214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).