4-[1-(1-amino-2,2,6,6-tetramethylpiperidin-4-yl)hexyl]-2,2,6,6-tetramethylpiperidin-1-amine

C24H50N4 — CID 140973554

IUPAC4-[1-(1-amino-2,2,6,6-tetramethylpiperidin-4-yl)hexyl]-2,2,6,6-tetramethylpiperidin-1-amine
SMILESCCCCCC(C1CC(C)(C)N(N)C(C)(C)C1)C1CC(C)(C)N(N)C(C)(C)C1
InChIInChI=1S/C24H50N4/c1-10-11-12-13-20(18-14-21(2,3)27(25)22(4,5)15-18)19-16-23(6,7)28(26)24(8,9)17-19/h18-20H,10-17,25-26H2,1-9H3
InChIKeyZSQQJSANYKRBNC-UHFFFAOYSA-N
MW394.69 g/mol
LogP5.47
Rot. Bonds6

About 4-[1-(1-amino-2,2,6,6-tetramethylpiperidin-4-yl)hexyl]-2,2,6,6-tetramethylpiperidin-1-amine

4-[1-(1-amino-2,2,6,6-tetramethylpiperidin-4-yl)hexyl]-2,2,6,6-tetramethylpiperidin-1-amine (PubChem CID 140973554) has the molecular formula C24H50N4 and a molecular weight of 394.69 g/mol. Its IUPAC name is 4-[1-(1-amino-2,2,6,6-tetramethylpiperidin-4-yl)hexyl]-2,2,6,6-tetramethylpiperidin-1-amine.

Molecular Properties

Compound Name4-[1-(1-amino-2,2,6,6-tetramethylpiperidin-4-yl)hexyl]-2,2,6,6-tetramethylpiperidin-1-amine
PubChem CID140973554
Molecular FormulaC24H50N4
Molecular Weight394.69 g/mol
Exact Mass394.40
IUPAC Name4-[1-(1-amino-2,2,6,6-tetramethylpiperidin-4-yl)hexyl]-2,2,6,6-tetramethylpiperidin-1-amine
SMILESCCCCCC(C1CC(C)(C)N(N)C(C)(C)C1)C1CC(C)(C)N(N)C(C)(C)C1
InChIInChI=1S/C24H50N4/c1-10-11-12-13-20(18-14-21(2,3)27(25)22(4,5)15-18)19-16-23(6,7)28(26)24(8,9)17-19/h18-20H,10-17,25-26H2,1-9H3
InChIKeyZSQQJSANYKRBNC-UHFFFAOYSA-N
XLogP5.47
TPSA58.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500394.69
LogP ≤ 55.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-[1-(1-amino-2,2,6,6-tetramethylpiperidin-4-yl)hexyl]-2,2,6,6-tetramethylpiperidin-1-amine?
The IUPAC name of 4-[1-(1-amino-2,2,6,6-tetramethylpiperidin-4-yl)hexyl]-2,2,6,6-tetramethylpiperidin-1-amine (CID 140973554) is 4-[1-(1-amino-2,2,6,6-tetramethylpiperidin-4-yl)hexyl]-2,2,6,6-tetramethylpiperidin-1-amine.
What is the SMILES notation for 4-[1-(1-amino-2,2,6,6-tetramethylpiperidin-4-yl)hexyl]-2,2,6,6-tetramethylpiperidin-1-amine?
The canonical SMILES for 4-[1-(1-amino-2,2,6,6-tetramethylpiperidin-4-yl)hexyl]-2,2,6,6-tetramethylpiperidin-1-amine is CCCCCC(C1CC(C)(C)N(N)C(C)(C)C1)C1CC(C)(C)N(N)C(C)(C)C1.
What is the InChIKey of 4-[1-(1-amino-2,2,6,6-tetramethylpiperidin-4-yl)hexyl]-2,2,6,6-tetramethylpiperidin-1-amine?
The InChIKey is ZSQQJSANYKRBNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H50N4/c1-10-11-12-13-20(18-14-21(2,3)27(25)22(4,5)15-18)19-16-23(6,7)28(26)24(8,9)17-19/h18-20H,10-17,25-26H2,1-9H3.
What are the key properties of 4-[1-(1-amino-2,2,6,6-tetramethylpiperidin-4-yl)hexyl]-2,2,6,6-tetramethylpiperidin-1-amine?
4-[1-(1-amino-2,2,6,6-tetramethylpiperidin-4-yl)hexyl]-2,2,6,6-tetramethylpiperidin-1-amine has a molecular weight of 394.69 g/mol, XLogP of 5.47, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(1-amino-2,2,6,6-tetramethylpiperidin-4-yl)hexyl]-2,2,6,6-tetramethylpiperidin-1-amine is sourced from PubChem (CID 140973554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).