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

C9H18ClNO — CID 14241395

IUPAC1-chloro-2,2,6,6-tetramethylpiperidin-4-ol
SMILESCC1(C)CC(O)CC(C)(C)N1Cl
InChIInChI=1S/C9H18ClNO/c1-8(2)5-7(12)6-9(3,4)11(8)10/h7,12H,5-6H2,1-4H3
InChIKeyAXYARDDRLAEERS-UHFFFAOYSA-N
MW191.70 g/mol
LogP2.15
Rot. Bonds

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

1-chloro-2,2,6,6-tetramethylpiperidin-4-ol (PubChem CID 14241395) has the molecular formula C9H18ClNO and a molecular weight of 191.70 g/mol. Its IUPAC name is 1-chloro-2,2,6,6-tetramethylpiperidin-4-ol.

Molecular Properties

Compound Name1-chloro-2,2,6,6-tetramethylpiperidin-4-ol
PubChem CID14241395
Molecular FormulaC9H18ClNO
Molecular Weight191.70 g/mol
Exact Mass191.11
IUPAC Name1-chloro-2,2,6,6-tetramethylpiperidin-4-ol
SMILESCC1(C)CC(O)CC(C)(C)N1Cl
InChIInChI=1S/C9H18ClNO/c1-8(2)5-7(12)6-9(3,4)11(8)10/h7,12H,5-6H2,1-4H3
InChIKeyAXYARDDRLAEERS-UHFFFAOYSA-N
XLogP2.15
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.70
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-chloro-2,2,6,6-tetramethylpiperidin-4-ol?
The IUPAC name of 1-chloro-2,2,6,6-tetramethylpiperidin-4-ol (CID 14241395) is 1-chloro-2,2,6,6-tetramethylpiperidin-4-ol.
What is the SMILES notation for 1-chloro-2,2,6,6-tetramethylpiperidin-4-ol?
The canonical SMILES for 1-chloro-2,2,6,6-tetramethylpiperidin-4-ol is CC1(C)CC(O)CC(C)(C)N1Cl.
What is the InChIKey of 1-chloro-2,2,6,6-tetramethylpiperidin-4-ol?
The InChIKey is AXYARDDRLAEERS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18ClNO/c1-8(2)5-7(12)6-9(3,4)11(8)10/h7,12H,5-6H2,1-4H3.
What are the key properties of 1-chloro-2,2,6,6-tetramethylpiperidin-4-ol?
1-chloro-2,2,6,6-tetramethylpiperidin-4-ol has a molecular weight of 191.70 g/mol, XLogP of 2.15, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-2,2,6,6-tetramethylpiperidin-4-ol is sourced from PubChem (CID 14241395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).