N-[6-[bis(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N-formylformamide

C26H50N4O2 — CID 22391836

IUPACN-[6-[bis(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N-formylformamide
SMILESCC1(C)CC(N(CCCCCCN(C=O)C=O)C2CC(C)(C)NC(C)(C)C2)CC(C)(C)N1
InChIInChI=1S/C26H50N4O2/c1-23(2)15-21(16-24(3,4)27-23)30(14-12-10-9-11-13-29(19-31)20-32)22-17-25(5,6)28-26(7,8)18-22/h19-22,27-28H,9-18H2,1-8H3
InChIKeyRQGFUEBLGXMAAP-UHFFFAOYSA-N
MW450.71 g/mol
LogP4.08
Rot. Bonds11

About N-[6-[bis(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N-formylformamide

N-[6-[bis(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N-formylformamide (PubChem CID 22391836) has the molecular formula C26H50N4O2 and a molecular weight of 450.71 g/mol. Its IUPAC name is N-[6-[bis(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N-formylformamide.

Molecular Properties

Compound NameN-[6-[bis(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N-formylformamide
PubChem CID22391836
Molecular FormulaC26H50N4O2
Molecular Weight450.71 g/mol
Exact Mass450.39
IUPAC NameN-[6-[bis(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N-formylformamide
SMILESCC1(C)CC(N(CCCCCCN(C=O)C=O)C2CC(C)(C)NC(C)(C)C2)CC(C)(C)N1
InChIInChI=1S/C26H50N4O2/c1-23(2)15-21(16-24(3,4)27-23)30(14-12-10-9-11-13-29(19-31)20-32)22-17-25(5,6)28-26(7,8)18-22/h19-22,27-28H,9-18H2,1-8H3
InChIKeyRQGFUEBLGXMAAP-UHFFFAOYSA-N
XLogP4.08
TPSA64.68 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500450.71
LogP ≤ 54.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N-[6-[bis(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N-formylformamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[6-[bis(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N-formylformamide?
The IUPAC name of N-[6-[bis(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N-formylformamide (CID 22391836) is N-[6-[bis(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N-formylformamide.
What is the SMILES notation for N-[6-[bis(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N-formylformamide?
The canonical SMILES for N-[6-[bis(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N-formylformamide is CC1(C)CC(N(CCCCCCN(C=O)C=O)C2CC(C)(C)NC(C)(C)C2)CC(C)(C)N1.
What is the InChIKey of N-[6-[bis(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N-formylformamide?
The InChIKey is RQGFUEBLGXMAAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H50N4O2/c1-23(2)15-21(16-24(3,4)27-23)30(14-12-10-9-11-13-29(19-31)20-32)22-17-25(5,6)28-26(7,8)18-22/h19-22,27-28H,9-18H2,1-8H3.
What are the key properties of N-[6-[bis(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N-formylformamide?
N-[6-[bis(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N-formylformamide has a molecular weight of 450.71 g/mol, XLogP of 4.08, 11 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[bis(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N-formylformamide is sourced from PubChem (CID 22391836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).