2-(2,6-difluorophenyl)-6-(2,2-dimethylpropyl)morpholine

C15H21F2NO — CID 107155067

IUPAC2-(2,6-difluorophenyl)-6-(2,2-dimethylpropyl)morpholine
SMILESCC(C)(C)CC1CNCC(c2c(F)cccc2F)O1
InChIInChI=1S/C15H21F2NO/c1-15(2,3)7-10-8-18-9-13(19-10)14-11(16)5-4-6-12(14)17/h4-6,10,13,18H,7-9H2,1-3H3
InChIKeyALYQARIRUMACCP-UHFFFAOYSA-N
MW269.33 g/mol
LogP3.43
Rot. Bonds2

About 2-(2,6-difluorophenyl)-6-(2,2-dimethylpropyl)morpholine

2-(2,6-difluorophenyl)-6-(2,2-dimethylpropyl)morpholine (PubChem CID 107155067) has the molecular formula C15H21F2NO and a molecular weight of 269.33 g/mol. Its IUPAC name is 2-(2,6-difluorophenyl)-6-(2,2-dimethylpropyl)morpholine.

Molecular Properties

Compound Name2-(2,6-difluorophenyl)-6-(2,2-dimethylpropyl)morpholine
PubChem CID107155067
Molecular FormulaC15H21F2NO
Molecular Weight269.33 g/mol
Exact Mass269.16
IUPAC Name2-(2,6-difluorophenyl)-6-(2,2-dimethylpropyl)morpholine
SMILESCC(C)(C)CC1CNCC(c2c(F)cccc2F)O1
InChIInChI=1S/C15H21F2NO/c1-15(2,3)7-10-8-18-9-13(19-10)14-11(16)5-4-6-12(14)17/h4-6,10,13,18H,7-9H2,1-3H3
InChIKeyALYQARIRUMACCP-UHFFFAOYSA-N
XLogP3.43
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.33
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,6-difluorophenyl)-6-(2,2-dimethylpropyl)morpholine?
The IUPAC name of 2-(2,6-difluorophenyl)-6-(2,2-dimethylpropyl)morpholine (CID 107155067) is 2-(2,6-difluorophenyl)-6-(2,2-dimethylpropyl)morpholine.
What is the SMILES notation for 2-(2,6-difluorophenyl)-6-(2,2-dimethylpropyl)morpholine?
The canonical SMILES for 2-(2,6-difluorophenyl)-6-(2,2-dimethylpropyl)morpholine is CC(C)(C)CC1CNCC(c2c(F)cccc2F)O1.
What is the InChIKey of 2-(2,6-difluorophenyl)-6-(2,2-dimethylpropyl)morpholine?
The InChIKey is ALYQARIRUMACCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21F2NO/c1-15(2,3)7-10-8-18-9-13(19-10)14-11(16)5-4-6-12(14)17/h4-6,10,13,18H,7-9H2,1-3H3.
What are the key properties of 2-(2,6-difluorophenyl)-6-(2,2-dimethylpropyl)morpholine?
2-(2,6-difluorophenyl)-6-(2,2-dimethylpropyl)morpholine has a molecular weight of 269.33 g/mol, XLogP of 3.43, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-difluorophenyl)-6-(2,2-dimethylpropyl)morpholine is sourced from PubChem (CID 107155067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).