2,6-diethyl-1,2,3,4,6-pentamethylpiperidine;2-N,4-N,6-trimethyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine

C40H78N8 — CID 157375415

IUPAC2,6-diethyl-1,2,3,4,6-pentamethylpiperidine;2-N,4-N,6-trimethyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine
SMILESCCC1(C)CC(C)C(C)C(C)(CC)N1C.Cc1nc(N(C)C2CC(C)(C)N(C)C(C)(C)C2)nc(N(C)C2CC(C)(C)N(C)C(C)(C)C2)n1
InChIInChI=1S/C26H49N7.C14H29N/c1-18-27-21(30(10)19-14-23(2,3)32(12)24(4,5)15-19)29-22(28-18)31(11)20-16-25(6,7)33(13)26(8,9)17-20;1-8-13(5)10-11(3)12(4)14(6,9-2)15(13)7/h19-20H,14-17H2,1-13H3;11-12H,8-10H2,1-7H3
InChIKeyBKGRKQFEVBSOCJ-UHFFFAOYSA-N
MW671.12 g/mol
LogP8.29
Rot. Bonds6

About 2,6-diethyl-1,2,3,4,6-pentamethylpiperidine;2-N,4-N,6-trimethyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine

2,6-diethyl-1,2,3,4,6-pentamethylpiperidine;2-N,4-N,6-trimethyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine (PubChem CID 157375415) has the molecular formula C40H78N8 and a molecular weight of 671.12 g/mol. Its IUPAC name is 2,6-diethyl-1,2,3,4,6-pentamethylpiperidine;2-N,4-N,6-trimethyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2,6-diethyl-1,2,3,4,6-pentamethylpiperidine;2-N,4-N,6-trimethyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine
PubChem CID157375415
Molecular FormulaC40H78N8
Molecular Weight671.12 g/mol
Exact Mass670.63
IUPAC Name2,6-diethyl-1,2,3,4,6-pentamethylpiperidine;2-N,4-N,6-trimethyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine
SMILESCCC1(C)CC(C)C(C)C(C)(CC)N1C.Cc1nc(N(C)C2CC(C)(C)N(C)C(C)(C)C2)nc(N(C)C2CC(C)(C)N(C)C(C)(C)C2)n1
InChIInChI=1S/C26H49N7.C14H29N/c1-18-27-21(30(10)19-14-23(2,3)32(12)24(4,5)15-19)29-22(28-18)31(11)20-16-25(6,7)33(13)26(8,9)17-20;1-8-13(5)10-11(3)12(4)14(6,9-2)15(13)7/h19-20H,14-17H2,1-13H3;11-12H,8-10H2,1-7H3
InChIKeyBKGRKQFEVBSOCJ-UHFFFAOYSA-N
XLogP8.29
TPSA54.87 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms48
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500671.12
LogP ≤ 58.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 2,6-diethyl-1,2,3,4,6-pentamethylpiperidine;2-N,4-N,6-trimethyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2,6-diethyl-1,2,3,4,6-pentamethylpiperidine;2-N,4-N,6-trimethyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2,6-diethyl-1,2,3,4,6-pentamethylpiperidine;2-N,4-N,6-trimethyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine (CID 157375415) is 2,6-diethyl-1,2,3,4,6-pentamethylpiperidine;2-N,4-N,6-trimethyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2,6-diethyl-1,2,3,4,6-pentamethylpiperidine;2-N,4-N,6-trimethyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2,6-diethyl-1,2,3,4,6-pentamethylpiperidine;2-N,4-N,6-trimethyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine is CCC1(C)CC(C)C(C)C(C)(CC)N1C.Cc1nc(N(C)C2CC(C)(C)N(C)C(C)(C)C2)nc(N(C)C2CC(C)(C)N(C)C(C)(C)C2)n1.
What is the InChIKey of 2,6-diethyl-1,2,3,4,6-pentamethylpiperidine;2-N,4-N,6-trimethyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine?
The InChIKey is BKGRKQFEVBSOCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H49N7.C14H29N/c1-18-27-21(30(10)19-14-23(2,3)32(12)24(4,5)15-19)29-22(28-18)31(11)20-16-25(6,7)33(13)26(8,9)17-20;1-8-13(5)10-11(3)12(4)14(6,9-2)15(13)7/h19-20H,14-17H2,1-13H3;11-12H,8-10H2,1-7H3.
What are the key properties of 2,6-diethyl-1,2,3,4,6-pentamethylpiperidine;2-N,4-N,6-trimethyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine?
2,6-diethyl-1,2,3,4,6-pentamethylpiperidine;2-N,4-N,6-trimethyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine has a molecular weight of 671.12 g/mol, XLogP of 8.29, 6 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-diethyl-1,2,3,4,6-pentamethylpiperidine;2-N,4-N,6-trimethyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 157375415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).