2-[4-(aminomethyl)-2,2,6,6-tetramethylpiperidin-1-yl]ethanol

C12H26N2O — CID 176904573

IUPAC2-[4-(aminomethyl)-2,2,6,6-tetramethylpiperidin-1-yl]ethanol
SMILESCC1(C)CC(CN)CC(C)(C)N1CCO
InChIInChI=1S/C12H26N2O/c1-11(2)7-10(9-13)8-12(3,4)14(11)5-6-15/h10,15H,5-9,13H2,1-4H3
InChIKeyQBRVTXSJZJXQLO-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.21
Rot. Bonds3

About 2-[4-(aminomethyl)-2,2,6,6-tetramethylpiperidin-1-yl]ethanol

2-[4-(aminomethyl)-2,2,6,6-tetramethylpiperidin-1-yl]ethanol (PubChem CID 176904573) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 2-[4-(aminomethyl)-2,2,6,6-tetramethylpiperidin-1-yl]ethanol.

Molecular Properties

Compound Name2-[4-(aminomethyl)-2,2,6,6-tetramethylpiperidin-1-yl]ethanol
PubChem CID176904573
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name2-[4-(aminomethyl)-2,2,6,6-tetramethylpiperidin-1-yl]ethanol
SMILESCC1(C)CC(CN)CC(C)(C)N1CCO
InChIInChI=1S/C12H26N2O/c1-11(2)7-10(9-13)8-12(3,4)14(11)5-6-15/h10,15H,5-9,13H2,1-4H3
InChIKeyQBRVTXSJZJXQLO-UHFFFAOYSA-N
XLogP1.21
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(aminomethyl)-2,2,6,6-tetramethylpiperidin-1-yl]ethanol?
The IUPAC name of 2-[4-(aminomethyl)-2,2,6,6-tetramethylpiperidin-1-yl]ethanol (CID 176904573) is 2-[4-(aminomethyl)-2,2,6,6-tetramethylpiperidin-1-yl]ethanol.
What is the SMILES notation for 2-[4-(aminomethyl)-2,2,6,6-tetramethylpiperidin-1-yl]ethanol?
The canonical SMILES for 2-[4-(aminomethyl)-2,2,6,6-tetramethylpiperidin-1-yl]ethanol is CC1(C)CC(CN)CC(C)(C)N1CCO.
What is the InChIKey of 2-[4-(aminomethyl)-2,2,6,6-tetramethylpiperidin-1-yl]ethanol?
The InChIKey is QBRVTXSJZJXQLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-11(2)7-10(9-13)8-12(3,4)14(11)5-6-15/h10,15H,5-9,13H2,1-4H3.
What are the key properties of 2-[4-(aminomethyl)-2,2,6,6-tetramethylpiperidin-1-yl]ethanol?
2-[4-(aminomethyl)-2,2,6,6-tetramethylpiperidin-1-yl]ethanol has a molecular weight of 214.35 g/mol, XLogP of 1.21, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(aminomethyl)-2,2,6,6-tetramethylpiperidin-1-yl]ethanol is sourced from PubChem (CID 176904573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).