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

C20H37ClN6 — CID 139073237

IUPAC6-chloro-4-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2-N-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazine-2,4-diamine
SMILESCC(C)(C)CC(C)(C)Nc1nc(Cl)nc(NC2CC(C)(C)NC(C)(C)C2)n1
InChIInChI=1S/C20H37ClN6/c1-17(2,3)12-20(8,9)26-16-24-14(21)23-15(25-16)22-13-10-18(4,5)27-19(6,7)11-13/h13,27H,10-12H2,1-9H3,(H2,22,23,24,25,26)
InChIKeyVUMYHPRTIXJROB-UHFFFAOYSA-N
MW397.01 g/mol
LogP4.87
Rot. Bonds5

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

6-chloro-4-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2-N-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazine-2,4-diamine (PubChem CID 139073237) has the molecular formula C20H37ClN6 and a molecular weight of 397.01 g/mol. Its IUPAC name is 6-chloro-4-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2-N-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-chloro-4-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2-N-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazine-2,4-diamine
PubChem CID139073237
Molecular FormulaC20H37ClN6
Molecular Weight397.01 g/mol
Exact Mass396.28
IUPAC Name6-chloro-4-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2-N-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazine-2,4-diamine
SMILESCC(C)(C)CC(C)(C)Nc1nc(Cl)nc(NC2CC(C)(C)NC(C)(C)C2)n1
InChIInChI=1S/C20H37ClN6/c1-17(2,3)12-20(8,9)26-16-24-14(21)23-15(25-16)22-13-10-18(4,5)27-19(6,7)11-13/h13,27H,10-12H2,1-9H3,(H2,22,23,24,25,26)
InChIKeyVUMYHPRTIXJROB-UHFFFAOYSA-N
XLogP4.87
TPSA74.76 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.01
LogP ≤ 54.87
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 6-chloro-4-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2-N-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazine-2,4-diamine with MolForge

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Launch Full Analysis

Related Compounds

Chimassorb 944
CID 93418
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
2,4-Dichloro-6-(N-(2,2,6,6-tetramethyl-4-piperidinyl)butylamino)-1,3,5-triazine
CID 6454726
2,2,6,6-Tetramethyl-4-(dichlorotriazin)aminopiperidine-1-oxyl
CID 3082236
4,6-dichloro-N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazin-2-amine
CID 54565461
N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine;4,6-dichloro-N-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazin-2-amine
CID 88239443
2,2,6,6-tetramethylpiperidine 4-amino-(N,N-dichlorotriazine)
CID 192179
2-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2-N-[6-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-4-N-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazine-2,4-diamine
CID 3446490
2-Chloro-4,6-bis(2,2,6,6-tetramethyl-4-piperidylamino)-1,3,5-triazine
CID 21468017
2-N,4-N,6-N,6-N-tetramethyl-4-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2-N-(trifluoromethyl)-1,3,5-triazine-2,4,6-triamine
CID 91550942
6-piperazin-1-yl-2-N,4-N-bis(2,4,4-trimethylpentan-2-yl)-1,3,5-triazine-2,4-diamine
CID 91377987
4-Chloro-6-(piperidin-1-yl)-N^2^-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazin-2-amine
CID 139072421

Frequently Asked Questions

What is the IUPAC name of 6-chloro-4-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2-N-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-chloro-4-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2-N-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazine-2,4-diamine (CID 139073237) is 6-chloro-4-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2-N-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-chloro-4-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2-N-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-chloro-4-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2-N-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazine-2,4-diamine is CC(C)(C)CC(C)(C)Nc1nc(Cl)nc(NC2CC(C)(C)NC(C)(C)C2)n1.
What is the InChIKey of 6-chloro-4-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2-N-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazine-2,4-diamine?
The InChIKey is VUMYHPRTIXJROB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H37ClN6/c1-17(2,3)12-20(8,9)26-16-24-14(21)23-15(25-16)22-13-10-18(4,5)27-19(6,7)11-13/h13,27H,10-12H2,1-9H3,(H2,22,23,24,25,26).
What are the key properties of 6-chloro-4-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2-N-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazine-2,4-diamine?
6-chloro-4-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2-N-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazine-2,4-diamine has a molecular weight of 397.01 g/mol, XLogP of 4.87, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-4-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2-N-(2,4,4-trimethylpentan-2-yl)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 139073237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).