1-butyl-2,2,6,6-tetramethylpiperidin-3-amine

C13H28N2 — CID 142764448

IUPAC1-butyl-2,2,6,6-tetramethylpiperidin-3-amine
SMILESCCCCN1C(C)(C)CCC(N)C1(C)C
InChIInChI=1S/C13H28N2/c1-6-7-10-15-12(2,3)9-8-11(14)13(15,4)5/h11H,6-10,14H2,1-5H3
InChIKeyXRNGCDFCRPYFAF-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.77
Rot. Bonds3

About 1-butyl-2,2,6,6-tetramethylpiperidin-3-amine

1-butyl-2,2,6,6-tetramethylpiperidin-3-amine (PubChem CID 142764448) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is 1-butyl-2,2,6,6-tetramethylpiperidin-3-amine.

Molecular Properties

Compound Name1-butyl-2,2,6,6-tetramethylpiperidin-3-amine
PubChem CID142764448
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC Name1-butyl-2,2,6,6-tetramethylpiperidin-3-amine
SMILESCCCCN1C(C)(C)CCC(N)C1(C)C
InChIInChI=1S/C13H28N2/c1-6-7-10-15-12(2,3)9-8-11(14)13(15,4)5/h11H,6-10,14H2,1-5H3
InChIKeyXRNGCDFCRPYFAF-UHFFFAOYSA-N
XLogP2.77
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-butyl-2,2,6,6-tetramethylpiperidin-3-amine?
The IUPAC name of 1-butyl-2,2,6,6-tetramethylpiperidin-3-amine (CID 142764448) is 1-butyl-2,2,6,6-tetramethylpiperidin-3-amine.
What is the SMILES notation for 1-butyl-2,2,6,6-tetramethylpiperidin-3-amine?
The canonical SMILES for 1-butyl-2,2,6,6-tetramethylpiperidin-3-amine is CCCCN1C(C)(C)CCC(N)C1(C)C.
What is the InChIKey of 1-butyl-2,2,6,6-tetramethylpiperidin-3-amine?
The InChIKey is XRNGCDFCRPYFAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-6-7-10-15-12(2,3)9-8-11(14)13(15,4)5/h11H,6-10,14H2,1-5H3.
What are the key properties of 1-butyl-2,2,6,6-tetramethylpiperidin-3-amine?
1-butyl-2,2,6,6-tetramethylpiperidin-3-amine has a molecular weight of 212.38 g/mol, XLogP of 2.77, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butyl-2,2,6,6-tetramethylpiperidin-3-amine is sourced from PubChem (CID 142764448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).