N,N'-bis(1-ethenyl-2,2,6,6-tetramethylpiperidin-4-yl)-N-methyl-N'-(4-methyl-6-morpholin-4-yl-1,3,5-triazin-2-yl)hexane-1,6-diamine

C37H66N8O — CID 163437924

IUPACN,N'-bis(1-ethenyl-2,2,6,6-tetramethylpiperidin-4-yl)-N-methyl-N'-(4-methyl-6-morpholin-4-yl-1,3,5-triazin-2-yl)hexane-1,6-diamine
SMILESC=CN1C(C)(C)CC(N(C)CCCCCCN(c2nc(C)nc(N3CCOCC3)n2)C2CC(C)(C)N(C=C)C(C)(C)C2)CC1(C)C
InChIInChI=1S/C37H66N8O/c1-13-44-34(4,5)25-30(26-35(44,6)7)41(12)19-17-15-16-18-20-43(31-27-36(8,9)45(14-2)37(10,11)28-31)33-39-29(3)38-32(40-33)42-21-23-46-24-22-42/h13-14,30-31H,1-2,15-28H2,3-12H3
InChIKeyAWBWYHGAOFFMMU-UHFFFAOYSA-N
MW638.99 g/mol
LogP6.65
Rot. Bonds13

About N,N'-bis(1-ethenyl-2,2,6,6-tetramethylpiperidin-4-yl)-N-methyl-N'-(4-methyl-6-morpholin-4-yl-1,3,5-triazin-2-yl)hexane-1,6-diamine

N,N'-bis(1-ethenyl-2,2,6,6-tetramethylpiperidin-4-yl)-N-methyl-N'-(4-methyl-6-morpholin-4-yl-1,3,5-triazin-2-yl)hexane-1,6-diamine (PubChem CID 163437924) has the molecular formula C37H66N8O and a molecular weight of 638.99 g/mol. Its IUPAC name is N,N'-bis(1-ethenyl-2,2,6,6-tetramethylpiperidin-4-yl)-N-methyl-N'-(4-methyl-6-morpholin-4-yl-1,3,5-triazin-2-yl)hexane-1,6-diamine.

Molecular Properties

Compound NameN,N'-bis(1-ethenyl-2,2,6,6-tetramethylpiperidin-4-yl)-N-methyl-N'-(4-methyl-6-morpholin-4-yl-1,3,5-triazin-2-yl)hexane-1,6-diamine
PubChem CID163437924
Molecular FormulaC37H66N8O
Molecular Weight638.99 g/mol
Exact Mass638.54
IUPAC NameN,N'-bis(1-ethenyl-2,2,6,6-tetramethylpiperidin-4-yl)-N-methyl-N'-(4-methyl-6-morpholin-4-yl-1,3,5-triazin-2-yl)hexane-1,6-diamine
SMILESC=CN1C(C)(C)CC(N(C)CCCCCCN(c2nc(C)nc(N3CCOCC3)n2)C2CC(C)(C)N(C=C)C(C)(C)C2)CC1(C)C
InChIInChI=1S/C37H66N8O/c1-13-44-34(4,5)25-30(26-35(44,6)7)41(12)19-17-15-16-18-20-43(31-27-36(8,9)45(14-2)37(10,11)28-31)33-39-29(3)38-32(40-33)42-21-23-46-24-22-42/h13-14,30-31H,1-2,15-28H2,3-12H3
InChIKeyAWBWYHGAOFFMMU-UHFFFAOYSA-N
XLogP6.65
TPSA64.10 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds13
Heavy Atoms46
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500638.99
LogP ≤ 56.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

Analyze N,N'-bis(1-ethenyl-2,2,6,6-tetramethylpiperidin-4-yl)-N-methyl-N'-(4-methyl-6-morpholin-4-yl-1,3,5-triazin-2-yl)hexane-1,6-diamine 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,N'-bis(1-ethenyl-2,2,6,6-tetramethylpiperidin-4-yl)-N-methyl-N'-(4-methyl-6-morpholin-4-yl-1,3,5-triazin-2-yl)hexane-1,6-diamine?
The IUPAC name of N,N'-bis(1-ethenyl-2,2,6,6-tetramethylpiperidin-4-yl)-N-methyl-N'-(4-methyl-6-morpholin-4-yl-1,3,5-triazin-2-yl)hexane-1,6-diamine (CID 163437924) is N,N'-bis(1-ethenyl-2,2,6,6-tetramethylpiperidin-4-yl)-N-methyl-N'-(4-methyl-6-morpholin-4-yl-1,3,5-triazin-2-yl)hexane-1,6-diamine.
What is the SMILES notation for N,N'-bis(1-ethenyl-2,2,6,6-tetramethylpiperidin-4-yl)-N-methyl-N'-(4-methyl-6-morpholin-4-yl-1,3,5-triazin-2-yl)hexane-1,6-diamine?
The canonical SMILES for N,N'-bis(1-ethenyl-2,2,6,6-tetramethylpiperidin-4-yl)-N-methyl-N'-(4-methyl-6-morpholin-4-yl-1,3,5-triazin-2-yl)hexane-1,6-diamine is C=CN1C(C)(C)CC(N(C)CCCCCCN(c2nc(C)nc(N3CCOCC3)n2)C2CC(C)(C)N(C=C)C(C)(C)C2)CC1(C)C.
What is the InChIKey of N,N'-bis(1-ethenyl-2,2,6,6-tetramethylpiperidin-4-yl)-N-methyl-N'-(4-methyl-6-morpholin-4-yl-1,3,5-triazin-2-yl)hexane-1,6-diamine?
The InChIKey is AWBWYHGAOFFMMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H66N8O/c1-13-44-34(4,5)25-30(26-35(44,6)7)41(12)19-17-15-16-18-20-43(31-27-36(8,9)45(14-2)37(10,11)28-31)33-39-29(3)38-32(40-33)42-21-23-46-24-22-42/h13-14,30-31H,1-2,15-28H2,3-12H3.
What are the key properties of N,N'-bis(1-ethenyl-2,2,6,6-tetramethylpiperidin-4-yl)-N-methyl-N'-(4-methyl-6-morpholin-4-yl-1,3,5-triazin-2-yl)hexane-1,6-diamine?
N,N'-bis(1-ethenyl-2,2,6,6-tetramethylpiperidin-4-yl)-N-methyl-N'-(4-methyl-6-morpholin-4-yl-1,3,5-triazin-2-yl)hexane-1,6-diamine has a molecular weight of 638.99 g/mol, XLogP of 6.65, 13 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-bis(1-ethenyl-2,2,6,6-tetramethylpiperidin-4-yl)-N-methyl-N'-(4-methyl-6-morpholin-4-yl-1,3,5-triazin-2-yl)hexane-1,6-diamine is sourced from PubChem (CID 163437924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).