6-morpholin-4-yl-2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine

C25H46N8O — CID 6611169

IUPAC6-morpholin-4-yl-2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine
SMILESCC1(C)CC(Nc2nc(NC3CC(C)(C)NC(C)(C)C3)nc(N3CCOCC3)n2)CC(C)(C)N1
InChIInChI=1S/C25H46N8O/c1-22(2)13-17(14-23(3,4)31-22)26-19-28-20(30-21(29-19)33-9-11-34-12-10-33)27-18-15-24(5,6)32-25(7,8)16-18/h17-18,31-32H,9-16H2,1-8H3,(H2,26,27,28,29,30)
InChIKeyRSCDYKOSFKPWIK-UHFFFAOYSA-N
MW474.70 g/mol
LogP3.15
Rot. Bonds5

About 6-morpholin-4-yl-2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine

6-morpholin-4-yl-2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine (PubChem CID 6611169) has the molecular formula C25H46N8O and a molecular weight of 474.70 g/mol. Its IUPAC name is 6-morpholin-4-yl-2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-morpholin-4-yl-2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine
PubChem CID6611169
Molecular FormulaC25H46N8O
Molecular Weight474.70 g/mol
Exact Mass474.38
IUPAC Name6-morpholin-4-yl-2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine
SMILESCC1(C)CC(Nc2nc(NC3CC(C)(C)NC(C)(C)C3)nc(N3CCOCC3)n2)CC(C)(C)N1
InChIInChI=1S/C25H46N8O/c1-22(2)13-17(14-23(3,4)31-22)26-19-28-20(30-21(29-19)33-9-11-34-12-10-33)27-18-15-24(5,6)32-25(7,8)16-18/h17-18,31-32H,9-16H2,1-8H3,(H2,26,27,28,29,30)
InChIKeyRSCDYKOSFKPWIK-UHFFFAOYSA-N
XLogP3.15
TPSA99.26 Ų
H-Bond Donors4
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500474.70
LogP ≤ 53.15
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 109

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Frequently Asked Questions

What is the IUPAC name of 6-morpholin-4-yl-2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-morpholin-4-yl-2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine (CID 6611169) is 6-morpholin-4-yl-2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-morpholin-4-yl-2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-morpholin-4-yl-2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine is CC1(C)CC(Nc2nc(NC3CC(C)(C)NC(C)(C)C3)nc(N3CCOCC3)n2)CC(C)(C)N1.
What is the InChIKey of 6-morpholin-4-yl-2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine?
The InChIKey is RSCDYKOSFKPWIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H46N8O/c1-22(2)13-17(14-23(3,4)31-22)26-19-28-20(30-21(29-19)33-9-11-34-12-10-33)27-18-15-24(5,6)32-25(7,8)16-18/h17-18,31-32H,9-16H2,1-8H3,(H2,26,27,28,29,30).
What are the key properties of 6-morpholin-4-yl-2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine?
6-morpholin-4-yl-2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine has a molecular weight of 474.70 g/mol, XLogP of 3.15, 5 rotatable bonds, 4 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 6-morpholin-4-yl-2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 6611169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).