2,2,6,6-tetramethyl-1-(2-phenylpropan-2-yloxy)piperidine

C18H29NO — CID 59327667

IUPAC2,2,6,6-tetramethyl-1-(2-phenylpropan-2-yloxy)piperidine
SMILESCC(C)(ON1C(C)(C)CCCC1(C)C)c1ccccc1
InChIInChI=1S/C18H29NO/c1-16(2)13-10-14-17(3,4)19(16)20-18(5,6)15-11-8-7-9-12-15/h7-9,11-12H,10,13-14H2,1-6H3
InChIKeyHMVSHELWGDSUJC-UHFFFAOYSA-N
MW275.44 g/mol
LogP4.90
Rot. Bonds3

About 2,2,6,6-tetramethyl-1-(2-phenylpropan-2-yloxy)piperidine

2,2,6,6-tetramethyl-1-(2-phenylpropan-2-yloxy)piperidine (PubChem CID 59327667) has the molecular formula C18H29NO and a molecular weight of 275.44 g/mol. Its IUPAC name is 2,2,6,6-tetramethyl-1-(2-phenylpropan-2-yloxy)piperidine.

Molecular Properties

Compound Name2,2,6,6-tetramethyl-1-(2-phenylpropan-2-yloxy)piperidine
PubChem CID59327667
Molecular FormulaC18H29NO
Molecular Weight275.44 g/mol
Exact Mass275.22
IUPAC Name2,2,6,6-tetramethyl-1-(2-phenylpropan-2-yloxy)piperidine
SMILESCC(C)(ON1C(C)(C)CCCC1(C)C)c1ccccc1
InChIInChI=1S/C18H29NO/c1-16(2)13-10-14-17(3,4)19(16)20-18(5,6)15-11-8-7-9-12-15/h7-9,11-12H,10,13-14H2,1-6H3
InChIKeyHMVSHELWGDSUJC-UHFFFAOYSA-N
XLogP4.90
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.44
LogP ≤ 54.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2,6,6-tetramethyl-1-(2-phenylpropan-2-yloxy)piperidine?
The IUPAC name of 2,2,6,6-tetramethyl-1-(2-phenylpropan-2-yloxy)piperidine (CID 59327667) is 2,2,6,6-tetramethyl-1-(2-phenylpropan-2-yloxy)piperidine.
What is the SMILES notation for 2,2,6,6-tetramethyl-1-(2-phenylpropan-2-yloxy)piperidine?
The canonical SMILES for 2,2,6,6-tetramethyl-1-(2-phenylpropan-2-yloxy)piperidine is CC(C)(ON1C(C)(C)CCCC1(C)C)c1ccccc1.
What is the InChIKey of 2,2,6,6-tetramethyl-1-(2-phenylpropan-2-yloxy)piperidine?
The InChIKey is HMVSHELWGDSUJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29NO/c1-16(2)13-10-14-17(3,4)19(16)20-18(5,6)15-11-8-7-9-12-15/h7-9,11-12H,10,13-14H2,1-6H3.
What are the key properties of 2,2,6,6-tetramethyl-1-(2-phenylpropan-2-yloxy)piperidine?
2,2,6,6-tetramethyl-1-(2-phenylpropan-2-yloxy)piperidine has a molecular weight of 275.44 g/mol, XLogP of 4.90, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,6,6-tetramethyl-1-(2-phenylpropan-2-yloxy)piperidine is sourced from PubChem (CID 59327667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).