1-(2,2,6,6-tetramethylpiperidin-1-yl)hexane-1,6-diamine

C15H33N3 — CID 54134757

IUPAC1-(2,2,6,6-tetramethylpiperidin-1-yl)hexane-1,6-diamine
SMILESCC1(C)CCCC(C)(C)N1C(N)CCCCCN
InChIInChI=1S/C15H33N3/c1-14(2)10-8-11-15(3,4)18(14)13(17)9-6-5-7-12-16/h13H,5-12,16-17H2,1-4H3
InChIKeyNWWWCQXWCJRMTI-UHFFFAOYSA-N
MW255.45 g/mol
LogP2.83
Rot. Bonds6

About 1-(2,2,6,6-tetramethylpiperidin-1-yl)hexane-1,6-diamine

1-(2,2,6,6-tetramethylpiperidin-1-yl)hexane-1,6-diamine (PubChem CID 54134757) has the molecular formula C15H33N3 and a molecular weight of 255.45 g/mol. Its IUPAC name is 1-(2,2,6,6-tetramethylpiperidin-1-yl)hexane-1,6-diamine.

Molecular Properties

Compound Name1-(2,2,6,6-tetramethylpiperidin-1-yl)hexane-1,6-diamine
PubChem CID54134757
Molecular FormulaC15H33N3
Molecular Weight255.45 g/mol
Exact Mass255.27
IUPAC Name1-(2,2,6,6-tetramethylpiperidin-1-yl)hexane-1,6-diamine
SMILESCC1(C)CCCC(C)(C)N1C(N)CCCCCN
InChIInChI=1S/C15H33N3/c1-14(2)10-8-11-15(3,4)18(14)13(17)9-6-5-7-12-16/h13H,5-12,16-17H2,1-4H3
InChIKeyNWWWCQXWCJRMTI-UHFFFAOYSA-N
XLogP2.83
TPSA55.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.45
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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 1-(2,2,6,6-tetramethylpiperidin-1-yl)hexane-1,6-diamine?
The IUPAC name of 1-(2,2,6,6-tetramethylpiperidin-1-yl)hexane-1,6-diamine (CID 54134757) is 1-(2,2,6,6-tetramethylpiperidin-1-yl)hexane-1,6-diamine.
What is the SMILES notation for 1-(2,2,6,6-tetramethylpiperidin-1-yl)hexane-1,6-diamine?
The canonical SMILES for 1-(2,2,6,6-tetramethylpiperidin-1-yl)hexane-1,6-diamine is CC1(C)CCCC(C)(C)N1C(N)CCCCCN.
What is the InChIKey of 1-(2,2,6,6-tetramethylpiperidin-1-yl)hexane-1,6-diamine?
The InChIKey is NWWWCQXWCJRMTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33N3/c1-14(2)10-8-11-15(3,4)18(14)13(17)9-6-5-7-12-16/h13H,5-12,16-17H2,1-4H3.
What are the key properties of 1-(2,2,6,6-tetramethylpiperidin-1-yl)hexane-1,6-diamine?
1-(2,2,6,6-tetramethylpiperidin-1-yl)hexane-1,6-diamine has a molecular weight of 255.45 g/mol, XLogP of 2.83, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2,6,6-tetramethylpiperidin-1-yl)hexane-1,6-diamine is sourced from PubChem (CID 54134757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).