2-[[(2,2,6,6-tetramethylpiperidin-4-yl)amino]methyl]phenol

C16H26N2O — CID 566707

IUPAC2-[[(2,2,6,6-tetramethylpiperidin-4-yl)amino]methyl]phenol
SMILESCC1(C)CC(NCc2ccccc2O)CC(C)(C)N1
InChIInChI=1S/C16H26N2O/c1-15(2)9-13(10-16(3,4)18-15)17-11-12-7-5-6-8-14(12)19/h5-8,13,17-19H,9-11H2,1-4H3
InChIKeyISXGYJNEVXELQL-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.79
Rot. Bonds3

About 2-[[(2,2,6,6-tetramethylpiperidin-4-yl)amino]methyl]phenol

2-[[(2,2,6,6-tetramethylpiperidin-4-yl)amino]methyl]phenol (PubChem CID 566707) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 2-[[(2,2,6,6-tetramethylpiperidin-4-yl)amino]methyl]phenol.

Molecular Properties

Compound Name2-[[(2,2,6,6-tetramethylpiperidin-4-yl)amino]methyl]phenol
PubChem CID566707
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name2-[[(2,2,6,6-tetramethylpiperidin-4-yl)amino]methyl]phenol
SMILESCC1(C)CC(NCc2ccccc2O)CC(C)(C)N1
InChIInChI=1S/C16H26N2O/c1-15(2)9-13(10-16(3,4)18-15)17-11-12-7-5-6-8-14(12)19/h5-8,13,17-19H,9-11H2,1-4H3
InChIKeyISXGYJNEVXELQL-UHFFFAOYSA-N
XLogP2.79
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.79
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[[(2,2,6,6-tetramethylpiperidin-4-yl)amino]methyl]phenol?
The IUPAC name of 2-[[(2,2,6,6-tetramethylpiperidin-4-yl)amino]methyl]phenol (CID 566707) is 2-[[(2,2,6,6-tetramethylpiperidin-4-yl)amino]methyl]phenol.
What is the SMILES notation for 2-[[(2,2,6,6-tetramethylpiperidin-4-yl)amino]methyl]phenol?
The canonical SMILES for 2-[[(2,2,6,6-tetramethylpiperidin-4-yl)amino]methyl]phenol is CC1(C)CC(NCc2ccccc2O)CC(C)(C)N1.
What is the InChIKey of 2-[[(2,2,6,6-tetramethylpiperidin-4-yl)amino]methyl]phenol?
The InChIKey is ISXGYJNEVXELQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-15(2)9-13(10-16(3,4)18-15)17-11-12-7-5-6-8-14(12)19/h5-8,13,17-19H,9-11H2,1-4H3.
What are the key properties of 2-[[(2,2,6,6-tetramethylpiperidin-4-yl)amino]methyl]phenol?
2-[[(2,2,6,6-tetramethylpiperidin-4-yl)amino]methyl]phenol has a molecular weight of 262.40 g/mol, XLogP of 2.79, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(2,2,6,6-tetramethylpiperidin-4-yl)amino]methyl]phenol is sourced from PubChem (CID 566707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).