4,6-dimethoxy-N-[1-(2,2,6,6-tetramethylpiperidin-4-yl)butyl]-1,3,5-triazin-2-amine

C18H33N5O2 — CID 70409296

IUPAC4,6-dimethoxy-N-[1-(2,2,6,6-tetramethylpiperidin-4-yl)butyl]-1,3,5-triazin-2-amine
SMILESCCCC(Nc1nc(OC)nc(OC)n1)C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C18H33N5O2/c1-8-9-13(12-10-17(2,3)23-18(4,5)11-12)19-14-20-15(24-6)22-16(21-14)25-7/h12-13,23H,8-11H2,1-7H3,(H,19,20,21,22)
InChIKeyNBXPBXFCDWSHLN-UHFFFAOYSA-N
MW351.50 g/mol
LogP3.03
Rot. Bonds7

About 4,6-dimethoxy-N-[1-(2,2,6,6-tetramethylpiperidin-4-yl)butyl]-1,3,5-triazin-2-amine

4,6-dimethoxy-N-[1-(2,2,6,6-tetramethylpiperidin-4-yl)butyl]-1,3,5-triazin-2-amine (PubChem CID 70409296) has the molecular formula C18H33N5O2 and a molecular weight of 351.50 g/mol. Its IUPAC name is 4,6-dimethoxy-N-[1-(2,2,6,6-tetramethylpiperidin-4-yl)butyl]-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4,6-dimethoxy-N-[1-(2,2,6,6-tetramethylpiperidin-4-yl)butyl]-1,3,5-triazin-2-amine
PubChem CID70409296
Molecular FormulaC18H33N5O2
Molecular Weight351.50 g/mol
Exact Mass351.26
IUPAC Name4,6-dimethoxy-N-[1-(2,2,6,6-tetramethylpiperidin-4-yl)butyl]-1,3,5-triazin-2-amine
SMILESCCCC(Nc1nc(OC)nc(OC)n1)C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C18H33N5O2/c1-8-9-13(12-10-17(2,3)23-18(4,5)11-12)19-14-20-15(24-6)22-16(21-14)25-7/h12-13,23H,8-11H2,1-7H3,(H,19,20,21,22)
InChIKeyNBXPBXFCDWSHLN-UHFFFAOYSA-N
XLogP3.03
TPSA81.19 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.50
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4,6-dimethoxy-N-[1-(2,2,6,6-tetramethylpiperidin-4-yl)butyl]-1,3,5-triazin-2-amine?
The IUPAC name of 4,6-dimethoxy-N-[1-(2,2,6,6-tetramethylpiperidin-4-yl)butyl]-1,3,5-triazin-2-amine (CID 70409296) is 4,6-dimethoxy-N-[1-(2,2,6,6-tetramethylpiperidin-4-yl)butyl]-1,3,5-triazin-2-amine.
What is the SMILES notation for 4,6-dimethoxy-N-[1-(2,2,6,6-tetramethylpiperidin-4-yl)butyl]-1,3,5-triazin-2-amine?
The canonical SMILES for 4,6-dimethoxy-N-[1-(2,2,6,6-tetramethylpiperidin-4-yl)butyl]-1,3,5-triazin-2-amine is CCCC(Nc1nc(OC)nc(OC)n1)C1CC(C)(C)NC(C)(C)C1.
What is the InChIKey of 4,6-dimethoxy-N-[1-(2,2,6,6-tetramethylpiperidin-4-yl)butyl]-1,3,5-triazin-2-amine?
The InChIKey is NBXPBXFCDWSHLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H33N5O2/c1-8-9-13(12-10-17(2,3)23-18(4,5)11-12)19-14-20-15(24-6)22-16(21-14)25-7/h12-13,23H,8-11H2,1-7H3,(H,19,20,21,22).
What are the key properties of 4,6-dimethoxy-N-[1-(2,2,6,6-tetramethylpiperidin-4-yl)butyl]-1,3,5-triazin-2-amine?
4,6-dimethoxy-N-[1-(2,2,6,6-tetramethylpiperidin-4-yl)butyl]-1,3,5-triazin-2-amine has a molecular weight of 351.50 g/mol, XLogP of 3.03, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethoxy-N-[1-(2,2,6,6-tetramethylpiperidin-4-yl)butyl]-1,3,5-triazin-2-amine is sourced from PubChem (CID 70409296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).