3,3,5,5-tetramethyl-4-[(5-propan-2-ylfuran-2-yl)methyl]morpholine

C16H27NO2 — CID 162741236

IUPAC3,3,5,5-tetramethyl-4-[(5-propan-2-ylfuran-2-yl)methyl]morpholine
SMILESCC(C)c1ccc(CN2C(C)(C)COCC2(C)C)o1
InChIInChI=1S/C16H27NO2/c1-12(2)14-8-7-13(19-14)9-17-15(3,4)10-18-11-16(17,5)6/h7-8,12H,9-11H2,1-6H3
InChIKeyZQLJKAITGQFFPX-UHFFFAOYSA-N
MW265.40 g/mol
LogP3.79
Rot. Bonds3

About 3,3,5,5-tetramethyl-4-[(5-propan-2-ylfuran-2-yl)methyl]morpholine

3,3,5,5-tetramethyl-4-[(5-propan-2-ylfuran-2-yl)methyl]morpholine (PubChem CID 162741236) has the molecular formula C16H27NO2 and a molecular weight of 265.40 g/mol. Its IUPAC name is 3,3,5,5-tetramethyl-4-[(5-propan-2-ylfuran-2-yl)methyl]morpholine.

Molecular Properties

Compound Name3,3,5,5-tetramethyl-4-[(5-propan-2-ylfuran-2-yl)methyl]morpholine
PubChem CID162741236
Molecular FormulaC16H27NO2
Molecular Weight265.40 g/mol
Exact Mass265.20
IUPAC Name3,3,5,5-tetramethyl-4-[(5-propan-2-ylfuran-2-yl)methyl]morpholine
SMILESCC(C)c1ccc(CN2C(C)(C)COCC2(C)C)o1
InChIInChI=1S/C16H27NO2/c1-12(2)14-8-7-13(19-14)9-17-15(3,4)10-18-11-16(17,5)6/h7-8,12H,9-11H2,1-6H3
InChIKeyZQLJKAITGQFFPX-UHFFFAOYSA-N
XLogP3.79
TPSA25.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,3,5,5-tetramethyl-4-[(5-propan-2-ylfuran-2-yl)methyl]morpholine?
The IUPAC name of 3,3,5,5-tetramethyl-4-[(5-propan-2-ylfuran-2-yl)methyl]morpholine (CID 162741236) is 3,3,5,5-tetramethyl-4-[(5-propan-2-ylfuran-2-yl)methyl]morpholine.
What is the SMILES notation for 3,3,5,5-tetramethyl-4-[(5-propan-2-ylfuran-2-yl)methyl]morpholine?
The canonical SMILES for 3,3,5,5-tetramethyl-4-[(5-propan-2-ylfuran-2-yl)methyl]morpholine is CC(C)c1ccc(CN2C(C)(C)COCC2(C)C)o1.
What is the InChIKey of 3,3,5,5-tetramethyl-4-[(5-propan-2-ylfuran-2-yl)methyl]morpholine?
The InChIKey is ZQLJKAITGQFFPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NO2/c1-12(2)14-8-7-13(19-14)9-17-15(3,4)10-18-11-16(17,5)6/h7-8,12H,9-11H2,1-6H3.
What are the key properties of 3,3,5,5-tetramethyl-4-[(5-propan-2-ylfuran-2-yl)methyl]morpholine?
3,3,5,5-tetramethyl-4-[(5-propan-2-ylfuran-2-yl)methyl]morpholine has a molecular weight of 265.40 g/mol, XLogP of 3.79, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3,5,5-tetramethyl-4-[(5-propan-2-ylfuran-2-yl)methyl]morpholine is sourced from PubChem (CID 162741236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).