1-hexyl-2,2,6,6-tetramethylpiperidin-4-ol

C15H31NO — CID 54003994

IUPAC1-hexyl-2,2,6,6-tetramethylpiperidin-4-ol
SMILESCCCCCCN1C(C)(C)CC(O)CC1(C)C
InChIInChI=1S/C15H31NO/c1-6-7-8-9-10-16-14(2,3)11-13(17)12-15(16,4)5/h13,17H,6-12H2,1-5H3
InChIKeyKNOAHVRVDJBPCN-UHFFFAOYSA-N
MW241.42 g/mol
LogP3.58
Rot. Bonds5

About 1-hexyl-2,2,6,6-tetramethylpiperidin-4-ol

1-hexyl-2,2,6,6-tetramethylpiperidin-4-ol (PubChem CID 54003994) has the molecular formula C15H31NO and a molecular weight of 241.42 g/mol. Its IUPAC name is 1-hexyl-2,2,6,6-tetramethylpiperidin-4-ol.

Molecular Properties

Compound Name1-hexyl-2,2,6,6-tetramethylpiperidin-4-ol
PubChem CID54003994
Molecular FormulaC15H31NO
Molecular Weight241.42 g/mol
Exact Mass241.24
IUPAC Name1-hexyl-2,2,6,6-tetramethylpiperidin-4-ol
SMILESCCCCCCN1C(C)(C)CC(O)CC1(C)C
InChIInChI=1S/C15H31NO/c1-6-7-8-9-10-16-14(2,3)11-13(17)12-15(16,4)5/h13,17H,6-12H2,1-5H3
InChIKeyKNOAHVRVDJBPCN-UHFFFAOYSA-N
XLogP3.58
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.42
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-hexyl-2,2,6,6-tetramethylpiperidin-4-ol?
The IUPAC name of 1-hexyl-2,2,6,6-tetramethylpiperidin-4-ol (CID 54003994) is 1-hexyl-2,2,6,6-tetramethylpiperidin-4-ol.
What is the SMILES notation for 1-hexyl-2,2,6,6-tetramethylpiperidin-4-ol?
The canonical SMILES for 1-hexyl-2,2,6,6-tetramethylpiperidin-4-ol is CCCCCCN1C(C)(C)CC(O)CC1(C)C.
What is the InChIKey of 1-hexyl-2,2,6,6-tetramethylpiperidin-4-ol?
The InChIKey is KNOAHVRVDJBPCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31NO/c1-6-7-8-9-10-16-14(2,3)11-13(17)12-15(16,4)5/h13,17H,6-12H2,1-5H3.
What are the key properties of 1-hexyl-2,2,6,6-tetramethylpiperidin-4-ol?
1-hexyl-2,2,6,6-tetramethylpiperidin-4-ol has a molecular weight of 241.42 g/mol, XLogP of 3.58, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hexyl-2,2,6,6-tetramethylpiperidin-4-ol is sourced from PubChem (CID 54003994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).