2,4,8,12-tetramethyl-2-piperidin-1-yltridecan-3-ol

C22H45NO — CID 57092479

IUPAC2,4,8,12-tetramethyl-2-piperidin-1-yltridecan-3-ol
SMILESCC(C)CCCC(C)CCCC(C)C(O)C(C)(C)N1CCCCC1
InChIInChI=1S/C22H45NO/c1-18(2)12-10-13-19(3)14-11-15-20(4)21(24)22(5,6)23-16-8-7-9-17-23/h18-21,24H,7-17H2,1-6H3
InChIKeyRJRIIJCCSDBIHV-UHFFFAOYSA-N
MW339.61 g/mol
LogP5.88
Rot. Bonds11

About 2,4,8,12-tetramethyl-2-piperidin-1-yltridecan-3-ol

2,4,8,12-tetramethyl-2-piperidin-1-yltridecan-3-ol (PubChem CID 57092479) has the molecular formula C22H45NO and a molecular weight of 339.61 g/mol. Its IUPAC name is 2,4,8,12-tetramethyl-2-piperidin-1-yltridecan-3-ol.

Molecular Properties

Compound Name2,4,8,12-tetramethyl-2-piperidin-1-yltridecan-3-ol
PubChem CID57092479
Molecular FormulaC22H45NO
Molecular Weight339.61 g/mol
Exact Mass339.35
IUPAC Name2,4,8,12-tetramethyl-2-piperidin-1-yltridecan-3-ol
SMILESCC(C)CCCC(C)CCCC(C)C(O)C(C)(C)N1CCCCC1
InChIInChI=1S/C22H45NO/c1-18(2)12-10-13-19(3)14-11-15-20(4)21(24)22(5,6)23-16-8-7-9-17-23/h18-21,24H,7-17H2,1-6H3
InChIKeyRJRIIJCCSDBIHV-UHFFFAOYSA-N
XLogP5.88
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500339.61
LogP ≤ 55.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,4,8,12-tetramethyl-2-piperidin-1-yltridecan-3-ol?
The IUPAC name of 2,4,8,12-tetramethyl-2-piperidin-1-yltridecan-3-ol (CID 57092479) is 2,4,8,12-tetramethyl-2-piperidin-1-yltridecan-3-ol.
What is the SMILES notation for 2,4,8,12-tetramethyl-2-piperidin-1-yltridecan-3-ol?
The canonical SMILES for 2,4,8,12-tetramethyl-2-piperidin-1-yltridecan-3-ol is CC(C)CCCC(C)CCCC(C)C(O)C(C)(C)N1CCCCC1.
What is the InChIKey of 2,4,8,12-tetramethyl-2-piperidin-1-yltridecan-3-ol?
The InChIKey is RJRIIJCCSDBIHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H45NO/c1-18(2)12-10-13-19(3)14-11-15-20(4)21(24)22(5,6)23-16-8-7-9-17-23/h18-21,24H,7-17H2,1-6H3.
What are the key properties of 2,4,8,12-tetramethyl-2-piperidin-1-yltridecan-3-ol?
2,4,8,12-tetramethyl-2-piperidin-1-yltridecan-3-ol has a molecular weight of 339.61 g/mol, XLogP of 5.88, 11 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,8,12-tetramethyl-2-piperidin-1-yltridecan-3-ol is sourced from PubChem (CID 57092479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).