2-N,4-N-dibutyl-6-N,6-N-diethyl-2-N,4-N-bis(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine

C35H68N8O2 — CID 19768363

IUPAC2-N,4-N-dibutyl-6-N,6-N-diethyl-2-N,4-N-bis(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine
SMILESCCCCN(c1nc(N(CC)CC)nc(N(CCCC)C2CC(C)(C)N(OC)C(C)(C)C2)n1)C1CC(C)(C)N(OC)C(C)(C)C1
InChIInChI=1S/C35H68N8O2/c1-15-19-21-40(27-23-32(5,6)42(44-13)33(7,8)24-27)30-36-29(39(17-3)18-4)37-31(38-30)41(22-20-16-2)28-25-34(9,10)43(45-14)35(11,12)26-28/h27-28H,15-26H2,1-14H3
InChIKeyLIJTZTAZKPFKHT-UHFFFAOYSA-N
MW632.98 g/mol
LogP7.10
Rot. Bonds15

About 2-N,4-N-dibutyl-6-N,6-N-diethyl-2-N,4-N-bis(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine

2-N,4-N-dibutyl-6-N,6-N-diethyl-2-N,4-N-bis(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine (PubChem CID 19768363) has the molecular formula C35H68N8O2 and a molecular weight of 632.98 g/mol. Its IUPAC name is 2-N,4-N-dibutyl-6-N,6-N-diethyl-2-N,4-N-bis(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name2-N,4-N-dibutyl-6-N,6-N-diethyl-2-N,4-N-bis(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine
PubChem CID19768363
Molecular FormulaC35H68N8O2
Molecular Weight632.98 g/mol
Exact Mass632.55
IUPAC Name2-N,4-N-dibutyl-6-N,6-N-diethyl-2-N,4-N-bis(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine
SMILESCCCCN(c1nc(N(CC)CC)nc(N(CCCC)C2CC(C)(C)N(OC)C(C)(C)C2)n1)C1CC(C)(C)N(OC)C(C)(C)C1
InChIInChI=1S/C35H68N8O2/c1-15-19-21-40(27-23-32(5,6)42(44-13)33(7,8)24-27)30-36-29(39(17-3)18-4)37-31(38-30)41(22-20-16-2)28-25-34(9,10)43(45-14)35(11,12)26-28/h27-28H,15-26H2,1-14H3
InChIKeyLIJTZTAZKPFKHT-UHFFFAOYSA-N
XLogP7.10
TPSA73.33 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds15
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500632.98
LogP ≤ 57.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 2-N,4-N-dibutyl-6-N,6-N-diethyl-2-N,4-N-bis(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-N,4-N-dibutyl-6-N,6-N-diethyl-2-N,4-N-bis(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 2-N,4-N-dibutyl-6-N,6-N-diethyl-2-N,4-N-bis(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine (CID 19768363) is 2-N,4-N-dibutyl-6-N,6-N-diethyl-2-N,4-N-bis(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 2-N,4-N-dibutyl-6-N,6-N-diethyl-2-N,4-N-bis(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 2-N,4-N-dibutyl-6-N,6-N-diethyl-2-N,4-N-bis(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine is CCCCN(c1nc(N(CC)CC)nc(N(CCCC)C2CC(C)(C)N(OC)C(C)(C)C2)n1)C1CC(C)(C)N(OC)C(C)(C)C1.
What is the InChIKey of 2-N,4-N-dibutyl-6-N,6-N-diethyl-2-N,4-N-bis(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine?
The InChIKey is LIJTZTAZKPFKHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H68N8O2/c1-15-19-21-40(27-23-32(5,6)42(44-13)33(7,8)24-27)30-36-29(39(17-3)18-4)37-31(38-30)41(22-20-16-2)28-25-34(9,10)43(45-14)35(11,12)26-28/h27-28H,15-26H2,1-14H3.
What are the key properties of 2-N,4-N-dibutyl-6-N,6-N-diethyl-2-N,4-N-bis(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine?
2-N,4-N-dibutyl-6-N,6-N-diethyl-2-N,4-N-bis(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine has a molecular weight of 632.98 g/mol, XLogP of 7.10, 15 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,4-N-dibutyl-6-N,6-N-diethyl-2-N,4-N-bis(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 19768363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).