N-butyl-2,2,6,6-tetramethylpiperidin-1-amine

C13H28N2 — CID 22467689

IUPACN-butyl-2,2,6,6-tetramethylpiperidin-1-amine
SMILESCCCCNN1C(C)(C)CCCC1(C)C
InChIInChI=1S/C13H28N2/c1-6-7-11-14-15-12(2,3)9-8-10-13(15,4)5/h14H,6-11H2,1-5H3
InChIKeyRFOHWLRXZVHOBB-UHFFFAOYSA-N
MW212.38 g/mol
LogP3.33
Rot. Bonds4

About N-butyl-2,2,6,6-tetramethylpiperidin-1-amine

N-butyl-2,2,6,6-tetramethylpiperidin-1-amine (PubChem CID 22467689) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is N-butyl-2,2,6,6-tetramethylpiperidin-1-amine.

Molecular Properties

Compound NameN-butyl-2,2,6,6-tetramethylpiperidin-1-amine
PubChem CID22467689
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC NameN-butyl-2,2,6,6-tetramethylpiperidin-1-amine
SMILESCCCCNN1C(C)(C)CCCC1(C)C
InChIInChI=1S/C13H28N2/c1-6-7-11-14-15-12(2,3)9-8-10-13(15,4)5/h14H,6-11H2,1-5H3
InChIKeyRFOHWLRXZVHOBB-UHFFFAOYSA-N
XLogP3.33
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 53.33
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 N-butyl-2,2,6,6-tetramethylpiperidin-1-amine?
The IUPAC name of N-butyl-2,2,6,6-tetramethylpiperidin-1-amine (CID 22467689) is N-butyl-2,2,6,6-tetramethylpiperidin-1-amine.
What is the SMILES notation for N-butyl-2,2,6,6-tetramethylpiperidin-1-amine?
The canonical SMILES for N-butyl-2,2,6,6-tetramethylpiperidin-1-amine is CCCCNN1C(C)(C)CCCC1(C)C.
What is the InChIKey of N-butyl-2,2,6,6-tetramethylpiperidin-1-amine?
The InChIKey is RFOHWLRXZVHOBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-6-7-11-14-15-12(2,3)9-8-10-13(15,4)5/h14H,6-11H2,1-5H3.
What are the key properties of N-butyl-2,2,6,6-tetramethylpiperidin-1-amine?
N-butyl-2,2,6,6-tetramethylpiperidin-1-amine has a molecular weight of 212.38 g/mol, XLogP of 3.33, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-2,2,6,6-tetramethylpiperidin-1-amine is sourced from PubChem (CID 22467689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).