2-N,4-N-dibutyl-6-N-ethyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine

C33H64N8 — CID 59247834

IUPAC2-N,4-N-dibutyl-6-N-ethyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine
SMILESCCCCN(c1nc(NCC)nc(N(CCCC)C2CC(C)(C)N(C)C(C)(C)C2)n1)C1CC(C)(C)N(C)C(C)(C)C1
InChIInChI=1S/C33H64N8/c1-14-17-19-40(25-21-30(4,5)38(12)31(6,7)22-25)28-35-27(34-16-3)36-29(37-28)41(20-18-15-2)26-23-32(8,9)39(13)33(10,11)24-26/h25-26H,14-24H2,1-13H3,(H,34,35,36,37)
InChIKeyJXCYBAFSXYCDIY-UHFFFAOYSA-N
MW572.93 g/mol
LogP6.82
Rot. Bonds12

About 2-N,4-N-dibutyl-6-N-ethyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine

2-N,4-N-dibutyl-6-N-ethyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine (PubChem CID 59247834) has the molecular formula C33H64N8 and a molecular weight of 572.93 g/mol. Its IUPAC name is 2-N,4-N-dibutyl-6-N-ethyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name2-N,4-N-dibutyl-6-N-ethyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine
PubChem CID59247834
Molecular FormulaC33H64N8
Molecular Weight572.93 g/mol
Exact Mass572.53
IUPAC Name2-N,4-N-dibutyl-6-N-ethyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine
SMILESCCCCN(c1nc(NCC)nc(N(CCCC)C2CC(C)(C)N(C)C(C)(C)C2)n1)C1CC(C)(C)N(C)C(C)(C)C1
InChIInChI=1S/C33H64N8/c1-14-17-19-40(25-21-30(4,5)38(12)31(6,7)22-25)28-35-27(34-16-3)36-29(37-28)41(20-18-15-2)26-23-32(8,9)39(13)33(10,11)24-26/h25-26H,14-24H2,1-13H3,(H,34,35,36,37)
InChIKeyJXCYBAFSXYCDIY-UHFFFAOYSA-N
XLogP6.82
TPSA63.66 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds12
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500572.93
LogP ≤ 56.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 2-N,4-N-dibutyl-6-N-ethyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine with MolForge

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Related Compounds

2-N,4-N-didodecyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-6-N-tetradecyl-1,3,5-triazine-2,4,6-triamine
CID 59247815
2-N,4-N-dibutyl-6-N-methyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-6-N-propyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tributyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine
CID 158901910
2-N,4-N-dibutyl-6-N-[(hexylamino)methyl]-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine
CID 58004437
2-N-[6-[[4-[6-[[4,6-bis(dibutylamino)-1,3,5-triazin-2-yl]-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]hexyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]-6-[butyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]hexyl]-4-N,4-N,6-N,6-N-tetrabutyl-2-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine
CID 59655649
6-N-(2-bicyclo[2.2.1]heptanylmethyl)-2-N,4-N-dibutyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine
CID 59247816
2-N,4-N-dibutyl-6-N-[(hexylamino)methyl]-2-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)-4-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine;methane
CID 159566923
2-N-butyl-2-N-cyclopropyl-6-N-ethyl-4-N,4-N-dimethyl-1,3,5-triazine-2,4,6-triamine
CID 80799249
6-N-[2-[bis[2-[[4,6-bis[butyl-(2,2,6,6-tetramethyl-1-propoxypiperidin-4-yl)amino]-1,3,5-triazin-2-yl]amino]ethyl]amino]ethyl]-2-N,4-N-dibutyl-2-N,4-N-bis(2,2,6,6-tetramethyl-1-propoxypiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine
CID 88880341
2-[4-[butyl-[4-[butyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]-6-[butyl-(2,2,6,6-tetramethyl-1-prop-2-enylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]amino]-2,2,6,6-tetramethylpiperidin-1-yl]ethanol
CID 58612488
6-N-[3-(ethylamino)propyl]-2-N,4-N-dimethyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine
CID 138690349
6-N-[3-[6-[bis[3-[[4,6-bis[butyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]amino]propyl]amino]hexyl-[3-[[4,6-bis[butyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]amino]propyl]amino]propyl]-2-N,4-N-dibutyl-2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine
CID 59806376
2-N,4-N-dibutyl-2-N,4-N-bis(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine
CID 15218748

Frequently Asked Questions

What is the IUPAC name of 2-N,4-N-dibutyl-6-N-ethyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 2-N,4-N-dibutyl-6-N-ethyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine (CID 59247834) is 2-N,4-N-dibutyl-6-N-ethyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 2-N,4-N-dibutyl-6-N-ethyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 2-N,4-N-dibutyl-6-N-ethyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine is CCCCN(c1nc(NCC)nc(N(CCCC)C2CC(C)(C)N(C)C(C)(C)C2)n1)C1CC(C)(C)N(C)C(C)(C)C1.
What is the InChIKey of 2-N,4-N-dibutyl-6-N-ethyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine?
The InChIKey is JXCYBAFSXYCDIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H64N8/c1-14-17-19-40(25-21-30(4,5)38(12)31(6,7)22-25)28-35-27(34-16-3)36-29(37-28)41(20-18-15-2)26-23-32(8,9)39(13)33(10,11)24-26/h25-26H,14-24H2,1-13H3,(H,34,35,36,37).
What are the key properties of 2-N,4-N-dibutyl-6-N-ethyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine?
2-N,4-N-dibutyl-6-N-ethyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine has a molecular weight of 572.93 g/mol, XLogP of 6.82, 12 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,4-N-dibutyl-6-N-ethyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 59247834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).