2,2,5-trimethyl-6-(4-methylphenyl)morpholine

C14H21NO — CID 65102432

IUPAC2,2,5-trimethyl-6-(4-methylphenyl)morpholine
SMILESCc1ccc(C2OC(C)(C)CNC2C)cc1
InChIInChI=1S/C14H21NO/c1-10-5-7-12(8-6-10)13-11(2)15-9-14(3,4)16-13/h5-8,11,13,15H,9H2,1-4H3
InChIKeyWQGVBBBFYZGODX-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.82
Rot. Bonds1

About 2,2,5-trimethyl-6-(4-methylphenyl)morpholine

2,2,5-trimethyl-6-(4-methylphenyl)morpholine (PubChem CID 65102432) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 2,2,5-trimethyl-6-(4-methylphenyl)morpholine.

Molecular Properties

Compound Name2,2,5-trimethyl-6-(4-methylphenyl)morpholine
PubChem CID65102432
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name2,2,5-trimethyl-6-(4-methylphenyl)morpholine
SMILESCc1ccc(C2OC(C)(C)CNC2C)cc1
InChIInChI=1S/C14H21NO/c1-10-5-7-12(8-6-10)13-11(2)15-9-14(3,4)16-13/h5-8,11,13,15H,9H2,1-4H3
InChIKeyWQGVBBBFYZGODX-UHFFFAOYSA-N
XLogP2.82
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2,5-trimethyl-6-(4-methylphenyl)morpholine?
The IUPAC name of 2,2,5-trimethyl-6-(4-methylphenyl)morpholine (CID 65102432) is 2,2,5-trimethyl-6-(4-methylphenyl)morpholine.
What is the SMILES notation for 2,2,5-trimethyl-6-(4-methylphenyl)morpholine?
The canonical SMILES for 2,2,5-trimethyl-6-(4-methylphenyl)morpholine is Cc1ccc(C2OC(C)(C)CNC2C)cc1.
What is the InChIKey of 2,2,5-trimethyl-6-(4-methylphenyl)morpholine?
The InChIKey is WQGVBBBFYZGODX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-10-5-7-12(8-6-10)13-11(2)15-9-14(3,4)16-13/h5-8,11,13,15H,9H2,1-4H3.
What are the key properties of 2,2,5-trimethyl-6-(4-methylphenyl)morpholine?
2,2,5-trimethyl-6-(4-methylphenyl)morpholine has a molecular weight of 219.33 g/mol, XLogP of 2.82, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,5-trimethyl-6-(4-methylphenyl)morpholine is sourced from PubChem (CID 65102432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).