6-(2,5-dimethylphenyl)-2,2-dimethylmorpholine

C14H21NO — CID 65102537

IUPAC6-(2,5-dimethylphenyl)-2,2-dimethylmorpholine
SMILESCc1ccc(C)c(C2CNCC(C)(C)O2)c1
InChIInChI=1S/C14H21NO/c1-10-5-6-11(2)12(7-10)13-8-15-9-14(3,4)16-13/h5-7,13,15H,8-9H2,1-4H3
InChIKeyQEDTWPOTKHYDAU-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.74
Rot. Bonds1

About 6-(2,5-dimethylphenyl)-2,2-dimethylmorpholine

6-(2,5-dimethylphenyl)-2,2-dimethylmorpholine (PubChem CID 65102537) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 6-(2,5-dimethylphenyl)-2,2-dimethylmorpholine.

Molecular Properties

Compound Name6-(2,5-dimethylphenyl)-2,2-dimethylmorpholine
PubChem CID65102537
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name6-(2,5-dimethylphenyl)-2,2-dimethylmorpholine
SMILESCc1ccc(C)c(C2CNCC(C)(C)O2)c1
InChIInChI=1S/C14H21NO/c1-10-5-6-11(2)12(7-10)13-8-15-9-14(3,4)16-13/h5-7,13,15H,8-9H2,1-4H3
InChIKeyQEDTWPOTKHYDAU-UHFFFAOYSA-N
XLogP2.74
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 ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-(2,5-dimethylphenyl)-2,2-dimethylmorpholine?
The IUPAC name of 6-(2,5-dimethylphenyl)-2,2-dimethylmorpholine (CID 65102537) is 6-(2,5-dimethylphenyl)-2,2-dimethylmorpholine.
What is the SMILES notation for 6-(2,5-dimethylphenyl)-2,2-dimethylmorpholine?
The canonical SMILES for 6-(2,5-dimethylphenyl)-2,2-dimethylmorpholine is Cc1ccc(C)c(C2CNCC(C)(C)O2)c1.
What is the InChIKey of 6-(2,5-dimethylphenyl)-2,2-dimethylmorpholine?
The InChIKey is QEDTWPOTKHYDAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-10-5-6-11(2)12(7-10)13-8-15-9-14(3,4)16-13/h5-7,13,15H,8-9H2,1-4H3.
What are the key properties of 6-(2,5-dimethylphenyl)-2,2-dimethylmorpholine?
6-(2,5-dimethylphenyl)-2,2-dimethylmorpholine has a molecular weight of 219.33 g/mol, XLogP of 2.74, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,5-dimethylphenyl)-2,2-dimethylmorpholine is sourced from PubChem (CID 65102537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).