2-N,4-N-dibutyl-6-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-diamine

C31H59N7 — CID 18720560

IUPAC2-N,4-N-dibutyl-6-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-diamine
SMILESCCCCN(c1nc(C)nc(N(CCCC)C2CC(C)(C)N(C)C(C)(C)C2)n1)C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C31H59N7/c1-13-15-17-37(24-19-28(4,5)35-29(6,7)20-24)26-32-23(3)33-27(34-26)38(18-16-14-2)25-21-30(8,9)36(12)31(10,11)22-25/h24-25,35H,13-22H2,1-12H3
InChIKeyVTEMJJGBTPESBF-UHFFFAOYSA-N
MW529.86 g/mol
LogP6.35
Rot. Bonds10

About 2-N,4-N-dibutyl-6-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-diamine

2-N,4-N-dibutyl-6-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-diamine (PubChem CID 18720560) has the molecular formula C31H59N7 and a molecular weight of 529.86 g/mol. Its IUPAC name is 2-N,4-N-dibutyl-6-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-diamine.

Molecular Properties

Compound Name2-N,4-N-dibutyl-6-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-diamine
PubChem CID18720560
Molecular FormulaC31H59N7
Molecular Weight529.86 g/mol
Exact Mass529.48
IUPAC Name2-N,4-N-dibutyl-6-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-diamine
SMILESCCCCN(c1nc(C)nc(N(CCCC)C2CC(C)(C)N(C)C(C)(C)C2)n1)C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C31H59N7/c1-13-15-17-37(24-19-28(4,5)35-29(6,7)20-24)26-32-23(3)33-27(34-26)38(18-16-14-2)25-21-30(8,9)36(12)31(10,11)22-25/h24-25,35H,13-22H2,1-12H3
InChIKeyVTEMJJGBTPESBF-UHFFFAOYSA-N
XLogP6.35
TPSA60.42 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds10
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500529.86
LogP ≤ 56.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 2-N,4-N-dibutyl-6-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-diamine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-N,4-N-dibutyl-6-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-diamine?
The IUPAC name of 2-N,4-N-dibutyl-6-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-diamine (CID 18720560) is 2-N,4-N-dibutyl-6-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-diamine.
What is the SMILES notation for 2-N,4-N-dibutyl-6-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-diamine?
The canonical SMILES for 2-N,4-N-dibutyl-6-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-diamine is CCCCN(c1nc(C)nc(N(CCCC)C2CC(C)(C)N(C)C(C)(C)C2)n1)C1CC(C)(C)NC(C)(C)C1.
What is the InChIKey of 2-N,4-N-dibutyl-6-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-diamine?
The InChIKey is VTEMJJGBTPESBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H59N7/c1-13-15-17-37(24-19-28(4,5)35-29(6,7)20-24)26-32-23(3)33-27(34-26)38(18-16-14-2)25-21-30(8,9)36(12)31(10,11)22-25/h24-25,35H,13-22H2,1-12H3.
What are the key properties of 2-N,4-N-dibutyl-6-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-diamine?
2-N,4-N-dibutyl-6-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-diamine has a molecular weight of 529.86 g/mol, XLogP of 6.35, 10 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,4-N-dibutyl-6-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-diamine is sourced from PubChem (CID 18720560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).