1,2,5,6-tetramethyl-4-(2,2,3,3,5,5,6,6-octamethylpiperidin-1-yl)-1,3-diazinane

C21H43N3 — CID 18719723

IUPAC1,2,5,6-tetramethyl-4-(2,2,3,3,5,5,6,6-octamethylpiperidin-1-yl)-1,3-diazinane
SMILESCC1C(C)N(C)C(C)NC1N1C(C)(C)C(C)(C)CC(C)(C)C1(C)C
InChIInChI=1S/C21H43N3/c1-14-15(2)23(12)16(3)22-17(14)24-20(8,9)18(4,5)13-19(6,7)21(24,10)11/h14-17,22H,13H2,1-12H3
InChIKeySSKULDINXXZFJE-UHFFFAOYSA-N
MW337.60 g/mol
LogP4.53
Rot. Bonds1

About 1,2,5,6-tetramethyl-4-(2,2,3,3,5,5,6,6-octamethylpiperidin-1-yl)-1,3-diazinane

1,2,5,6-tetramethyl-4-(2,2,3,3,5,5,6,6-octamethylpiperidin-1-yl)-1,3-diazinane (PubChem CID 18719723) has the molecular formula C21H43N3 and a molecular weight of 337.60 g/mol. Its IUPAC name is 1,2,5,6-tetramethyl-4-(2,2,3,3,5,5,6,6-octamethylpiperidin-1-yl)-1,3-diazinane.

Molecular Properties

Compound Name1,2,5,6-tetramethyl-4-(2,2,3,3,5,5,6,6-octamethylpiperidin-1-yl)-1,3-diazinane
PubChem CID18719723
Molecular FormulaC21H43N3
Molecular Weight337.60 g/mol
Exact Mass337.35
IUPAC Name1,2,5,6-tetramethyl-4-(2,2,3,3,5,5,6,6-octamethylpiperidin-1-yl)-1,3-diazinane
SMILESCC1C(C)N(C)C(C)NC1N1C(C)(C)C(C)(C)CC(C)(C)C1(C)C
InChIInChI=1S/C21H43N3/c1-14-15(2)23(12)16(3)22-17(14)24-20(8,9)18(4,5)13-19(6,7)21(24,10)11/h14-17,22H,13H2,1-12H3
InChIKeySSKULDINXXZFJE-UHFFFAOYSA-N
XLogP4.53
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.60
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,2,5,6-tetramethyl-4-(2,2,3,3,5,5,6,6-octamethylpiperidin-1-yl)-1,3-diazinane?
The IUPAC name of 1,2,5,6-tetramethyl-4-(2,2,3,3,5,5,6,6-octamethylpiperidin-1-yl)-1,3-diazinane (CID 18719723) is 1,2,5,6-tetramethyl-4-(2,2,3,3,5,5,6,6-octamethylpiperidin-1-yl)-1,3-diazinane.
What is the SMILES notation for 1,2,5,6-tetramethyl-4-(2,2,3,3,5,5,6,6-octamethylpiperidin-1-yl)-1,3-diazinane?
The canonical SMILES for 1,2,5,6-tetramethyl-4-(2,2,3,3,5,5,6,6-octamethylpiperidin-1-yl)-1,3-diazinane is CC1C(C)N(C)C(C)NC1N1C(C)(C)C(C)(C)CC(C)(C)C1(C)C.
What is the InChIKey of 1,2,5,6-tetramethyl-4-(2,2,3,3,5,5,6,6-octamethylpiperidin-1-yl)-1,3-diazinane?
The InChIKey is SSKULDINXXZFJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H43N3/c1-14-15(2)23(12)16(3)22-17(14)24-20(8,9)18(4,5)13-19(6,7)21(24,10)11/h14-17,22H,13H2,1-12H3.
What are the key properties of 1,2,5,6-tetramethyl-4-(2,2,3,3,5,5,6,6-octamethylpiperidin-1-yl)-1,3-diazinane?
1,2,5,6-tetramethyl-4-(2,2,3,3,5,5,6,6-octamethylpiperidin-1-yl)-1,3-diazinane has a molecular weight of 337.60 g/mol, XLogP of 4.53, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,5,6-tetramethyl-4-(2,2,3,3,5,5,6,6-octamethylpiperidin-1-yl)-1,3-diazinane is sourced from PubChem (CID 18719723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).