2-N,4-N-dibenzyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine

C21H24N6O — CID 7589350

IUPAC2-N,4-N-dibenzyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
SMILESc1ccc(CNc2nc(NCc3ccccc3)nc(N3CCOCC3)n2)cc1
InChIInChI=1S/C21H24N6O/c1-3-7-17(8-4-1)15-22-19-24-20(23-16-18-9-5-2-6-10-18)26-21(25-19)27-11-13-28-14-12-27/h1-10H,11-16H2,(H2,22,23,24,25,26)
InChIKeySZUISRBWXKXLFJ-UHFFFAOYSA-N
MW376.46 g/mol
LogP2.93
Rot. Bonds7

About 2-N,4-N-dibenzyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine

2-N,4-N-dibenzyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine (PubChem CID 7589350) has the molecular formula C21H24N6O and a molecular weight of 376.46 g/mol. Its IUPAC name is 2-N,4-N-dibenzyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N,4-N-dibenzyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
PubChem CID7589350
Molecular FormulaC21H24N6O
Molecular Weight376.46 g/mol
Exact Mass376.20
IUPAC Name2-N,4-N-dibenzyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
SMILESc1ccc(CNc2nc(NCc3ccccc3)nc(N3CCOCC3)n2)cc1
InChIInChI=1S/C21H24N6O/c1-3-7-17(8-4-1)15-22-19-24-20(23-16-18-9-5-2-6-10-18)26-21(25-19)27-11-13-28-14-12-27/h1-10H,11-16H2,(H2,22,23,24,25,26)
InChIKeySZUISRBWXKXLFJ-UHFFFAOYSA-N
XLogP2.93
TPSA75.20 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 2-N,4-N-dibenzyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine with MolForge

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Launch Full Analysis

Related Compounds

N-Allyl-N'-benzyl-6-ethoxy-[1,3,5]triazine-2,4-diamine
CID 3121126
N-benzyl-6-(4-morpholinyl)-N'-[2-(4-morpholinyl)ethyl]-1,3,5-triazine-2,4-diamine
CID 1043362
2,4-Bismorpholino-6-benzylamino-1,3,5-triazine
CID 1068729
Benzyl-(4-hydrazino-6-morpholin-4-yl-[1,3,5]triazin-2-yl)-amine
CID 3119592
N-Benzyl-6-chloro-N'-(2-morpholin-4-yl-ethyl)-[1,3,5]triazine-2,4-diamine
CID 685322
N-(4-chlorobenzyl)-4,6-di-4-morpholinyl-1,3,5-triazin-2-amine
CID 1291127
N,N'-bis(3-methylphenyl)-6-(morpholin-4-yl)-1,3,5-triazine-2,4-diamine
CID 1327302
4-(4-benzylpiperidin-1-yl)-6-ethoxy-N-ethyl-1,3,5-triazin-2-amine
CID 4455755
2-N-[2-[2-(dimethylamino)ethoxy]ethyl]-4-N,6-N-bis[2-(4-fluorophenyl)ethyl]-1,3,5-triazine-2,4,6-triamine
CID 56647649
1,3,5-Triazine, 2-benzylamino-4-(4-fluorophenylamino)-6-(4-morpholyl)-
CID 633282
2-(4-Benzylpiperazin-1-yl)-4-(morpholin-4-yl)-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine
CID 1114000
N2,N4,N6-tribenzyl-1,3,5-triazine-2,4,6-triamine
CID 11372871

Frequently Asked Questions

What is the IUPAC name of 2-N,4-N-dibenzyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N,4-N-dibenzyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine (CID 7589350) is 2-N,4-N-dibenzyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N,4-N-dibenzyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N,4-N-dibenzyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine is c1ccc(CNc2nc(NCc3ccccc3)nc(N3CCOCC3)n2)cc1.
What is the InChIKey of 2-N,4-N-dibenzyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine?
The InChIKey is SZUISRBWXKXLFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N6O/c1-3-7-17(8-4-1)15-22-19-24-20(23-16-18-9-5-2-6-10-18)26-21(25-19)27-11-13-28-14-12-27/h1-10H,11-16H2,(H2,22,23,24,25,26).
What are the key properties of 2-N,4-N-dibenzyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine?
2-N,4-N-dibenzyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine has a molecular weight of 376.46 g/mol, XLogP of 2.93, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,4-N-dibenzyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 7589350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).