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

C21H39N7 — CID 15066137

IUPAC2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine
SMILESCC1(C)CC(Nc2ncnc(NC3CC(C)(C)NC(C)(C)C3)n2)CC(C)(C)N1
InChIInChI=1S/C21H39N7/c1-18(2)9-14(10-19(3,4)27-18)24-16-22-13-23-17(26-16)25-15-11-20(5,6)28-21(7,8)12-15/h13-15,27-28H,9-12H2,1-8H3,(H2,22,23,24,25,26)
InChIKeyJYGOUUQSMBQTPY-UHFFFAOYSA-N
MW389.59 g/mol
LogP3.31
Rot. Bonds4

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

2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine (PubChem CID 15066137) has the molecular formula C21H39N7 and a molecular weight of 389.59 g/mol. Its IUPAC name is 2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine
PubChem CID15066137
Molecular FormulaC21H39N7
Molecular Weight389.59 g/mol
Exact Mass389.33
IUPAC Name2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine
SMILESCC1(C)CC(Nc2ncnc(NC3CC(C)(C)NC(C)(C)C3)n2)CC(C)(C)N1
InChIInChI=1S/C21H39N7/c1-18(2)9-14(10-19(3,4)27-18)24-16-22-13-23-17(26-16)25-15-11-20(5,6)28-21(7,8)12-15/h13-15,27-28H,9-12H2,1-8H3,(H2,22,23,24,25,26)
InChIKeyJYGOUUQSMBQTPY-UHFFFAOYSA-N
XLogP3.31
TPSA86.79 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.59
LogP ≤ 53.31
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine (CID 15066137) is 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 2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine is CC1(C)CC(Nc2ncnc(NC3CC(C)(C)NC(C)(C)C3)n2)CC(C)(C)N1.
What is the InChIKey of 2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine?
The InChIKey is JYGOUUQSMBQTPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H39N7/c1-18(2)9-14(10-19(3,4)27-18)24-16-22-13-23-17(26-16)25-15-11-20(5,6)28-21(7,8)12-15/h13-15,27-28H,9-12H2,1-8H3,(H2,22,23,24,25,26).
What are the key properties of 2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine?
2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine has a molecular weight of 389.59 g/mol, XLogP of 3.31, 4 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 15066137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).