1-N,1-N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)ethane-1,1-diamine

C20H42N4 — CID 20547115

IUPAC1-N,1-N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)ethane-1,1-diamine
SMILESCC(NC1CC(C)(C)NC(C)(C)C1)NC1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C20H42N4/c1-14(21-15-10-17(2,3)23-18(4,5)11-15)22-16-12-19(6,7)24-20(8,9)13-16/h14-16,21-24H,10-13H2,1-9H3
InChIKeyWDOUYFQMSNLQGE-UHFFFAOYSA-N
MW338.58 g/mol
LogP3.13
Rot. Bonds4

About 1-N,1-N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)ethane-1,1-diamine

1-N,1-N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)ethane-1,1-diamine (PubChem CID 20547115) has the molecular formula C20H42N4 and a molecular weight of 338.58 g/mol. Its IUPAC name is 1-N,1-N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)ethane-1,1-diamine.

Molecular Properties

Compound Name1-N,1-N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)ethane-1,1-diamine
PubChem CID20547115
Molecular FormulaC20H42N4
Molecular Weight338.58 g/mol
Exact Mass338.34
IUPAC Name1-N,1-N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)ethane-1,1-diamine
SMILESCC(NC1CC(C)(C)NC(C)(C)C1)NC1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C20H42N4/c1-14(21-15-10-17(2,3)23-18(4,5)11-15)22-16-12-19(6,7)24-20(8,9)13-16/h14-16,21-24H,10-13H2,1-9H3
InChIKeyWDOUYFQMSNLQGE-UHFFFAOYSA-N
XLogP3.13
TPSA48.12 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.58
LogP ≤ 53.13
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-N,1-N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)ethane-1,1-diamine?
The IUPAC name of 1-N,1-N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)ethane-1,1-diamine (CID 20547115) is 1-N,1-N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)ethane-1,1-diamine.
What is the SMILES notation for 1-N,1-N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)ethane-1,1-diamine?
The canonical SMILES for 1-N,1-N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)ethane-1,1-diamine is CC(NC1CC(C)(C)NC(C)(C)C1)NC1CC(C)(C)NC(C)(C)C1.
What is the InChIKey of 1-N,1-N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)ethane-1,1-diamine?
The InChIKey is WDOUYFQMSNLQGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H42N4/c1-14(21-15-10-17(2,3)23-18(4,5)11-15)22-16-12-19(6,7)24-20(8,9)13-16/h14-16,21-24H,10-13H2,1-9H3.
What are the key properties of 1-N,1-N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)ethane-1,1-diamine?
1-N,1-N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)ethane-1,1-diamine has a molecular weight of 338.58 g/mol, XLogP of 3.13, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,1-N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)ethane-1,1-diamine is sourced from PubChem (CID 20547115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).