4-N,6-N-bis(prop-2-enyl)-2-N,2-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine

C27H48N8 — CID 54396012

IUPAC4-N,6-N-bis(prop-2-enyl)-2-N,2-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine
SMILESC=CCNc1nc(NCC=C)nc(N(C2CC(C)(C)NC(C)(C)C2)C2CC(C)(C)NC(C)(C)C2)n1
InChIInChI=1S/C27H48N8/c1-11-13-28-21-30-22(29-14-12-2)32-23(31-21)35(19-15-24(3,4)33-25(5,6)16-19)20-17-26(7,8)34-27(9,10)18-20/h11-12,19-20,33-34H,1-2,13-18H2,3-10H3,(H2,28,29,30,31,32)
InChIKeyVJZNVDYKUYZDMZ-UHFFFAOYSA-N
MW484.74 g/mol
LogP4.49
Rot. Bonds9

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

4-N,6-N-bis(prop-2-enyl)-2-N,2-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine (PubChem CID 54396012) has the molecular formula C27H48N8 and a molecular weight of 484.74 g/mol. Its IUPAC name is 4-N,6-N-bis(prop-2-enyl)-2-N,2-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name4-N,6-N-bis(prop-2-enyl)-2-N,2-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine
PubChem CID54396012
Molecular FormulaC27H48N8
Molecular Weight484.74 g/mol
Exact Mass484.40
IUPAC Name4-N,6-N-bis(prop-2-enyl)-2-N,2-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine
SMILESC=CCNc1nc(NCC=C)nc(N(C2CC(C)(C)NC(C)(C)C2)C2CC(C)(C)NC(C)(C)C2)n1
InChIInChI=1S/C27H48N8/c1-11-13-28-21-30-22(29-14-12-2)32-23(31-21)35(19-15-24(3,4)33-25(5,6)16-19)20-17-26(7,8)34-27(9,10)18-20/h11-12,19-20,33-34H,1-2,13-18H2,3-10H3,(H2,28,29,30,31,32)
InChIKeyVJZNVDYKUYZDMZ-UHFFFAOYSA-N
XLogP4.49
TPSA90.03 Ų
H-Bond Donors4
H-Bond Acceptors8
Rotatable Bonds9
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500484.74
LogP ≤ 54.49
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 4-N,6-N-bis(prop-2-enyl)-2-N,2-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine with MolForge

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Launch Full Analysis

Related Compounds

TK 12997
CID 163462
2,9,11,13,14-Pentaazabicyclo[8.3.1]tetradeca-1(14),10,12-trien-12-amine, N-(1,1,3,3-tetramethylbutyl)-2,9-bis(2,2,6,6-tetramethyl-4-piperidinyl)-
CID 91982043
1,3,5-Triazine-2,4,6-triamine, N,N',N''-tributyl-N,N',N''-tris(2,2,6,6-tetramethyl-4-piperidinyl)-
CID 156239
2-Chloro-4,6-bis(2,2,6,6-tetramethyl-4-piperidylamino)-1,3,5-triazine
CID 21468017
1-butyl-2,2,6,6-tetramethylpiperidin-4-amine;N'-(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine;2,4,6-trichloro-1,3,5-triazine
CID 44150185
2-Chloro-4,6-bis-(2,2,6,6-tetramethyl-4-piperidyl-butylamino)-1,3,5-triazine
CID 11114220
N-butyl-1-[4-[4-(butylamino)-2,2,6,6-tetramethylpiperidin-1-yl]-6-chloro-1,3,5-triazin-2-yl]-2,2,6,6-tetramethylpiperidin-4-amine
CID 11699446
2-[N,N-bis(2,2,6,6-tetramethyl-4-piperidyl)amino]-4,6-dichloro-1,3,5-triazine
CID 14365120
6-chloro-2-N,4-N-diethyl-2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine
CID 14746197
2-Chloro-4,6-bis[N-methyl-N-(2,2,6,6-tetramethyl-4-piperidyl)amino]-1,3,5-triazine
CID 14746198
2,4,6-Tris-(2,2,6,6-tetramethyl-4-piperidylamino)-1,3,5-triazine
CID 15883572
2-N,4-N-dioctyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-6-N-undecyl-1,3,5-triazine-2,4,6-triamine
CID 17764877

Frequently Asked Questions

What is the IUPAC name of 4-N,6-N-bis(prop-2-enyl)-2-N,2-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 4-N,6-N-bis(prop-2-enyl)-2-N,2-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine (CID 54396012) is 4-N,6-N-bis(prop-2-enyl)-2-N,2-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 4-N,6-N-bis(prop-2-enyl)-2-N,2-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 4-N,6-N-bis(prop-2-enyl)-2-N,2-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine is C=CCNc1nc(NCC=C)nc(N(C2CC(C)(C)NC(C)(C)C2)C2CC(C)(C)NC(C)(C)C2)n1.
What is the InChIKey of 4-N,6-N-bis(prop-2-enyl)-2-N,2-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine?
The InChIKey is VJZNVDYKUYZDMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H48N8/c1-11-13-28-21-30-22(29-14-12-2)32-23(31-21)35(19-15-24(3,4)33-25(5,6)16-19)20-17-26(7,8)34-27(9,10)18-20/h11-12,19-20,33-34H,1-2,13-18H2,3-10H3,(H2,28,29,30,31,32).
What are the key properties of 4-N,6-N-bis(prop-2-enyl)-2-N,2-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine?
4-N,6-N-bis(prop-2-enyl)-2-N,2-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine has a molecular weight of 484.74 g/mol, XLogP of 4.49, 9 rotatable bonds, 4 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N,6-N-bis(prop-2-enyl)-2-N,2-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 54396012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).