2-[(4,6-dianilino-1,3,5-triazin-2-yl)amino]ethanol

C17H18N6O — CID 2195709

IUPAC2-[(4,6-dianilino-1,3,5-triazin-2-yl)amino]ethanol
SMILESOCCNc1nc(Nc2ccccc2)nc(Nc2ccccc2)n1
InChIInChI=1S/C17H18N6O/c24-12-11-18-15-21-16(19-13-7-3-1-4-8-13)23-17(22-15)20-14-9-5-2-6-10-14/h1-10,24H,11-12H2,(H3,18,19,20,21,22,23)
InChIKeyVBWTXRISKRSIFJ-UHFFFAOYSA-N
MW322.37 g/mol
LogP2.76
Rot. Bonds7

About 2-[(4,6-dianilino-1,3,5-triazin-2-yl)amino]ethanol

2-[(4,6-dianilino-1,3,5-triazin-2-yl)amino]ethanol (PubChem CID 2195709) has the molecular formula C17H18N6O and a molecular weight of 322.37 g/mol. Its IUPAC name is 2-[(4,6-dianilino-1,3,5-triazin-2-yl)amino]ethanol.

Molecular Properties

Compound Name2-[(4,6-dianilino-1,3,5-triazin-2-yl)amino]ethanol
PubChem CID2195709
Molecular FormulaC17H18N6O
Molecular Weight322.37 g/mol
Exact Mass322.15
IUPAC Name2-[(4,6-dianilino-1,3,5-triazin-2-yl)amino]ethanol
SMILESOCCNc1nc(Nc2ccccc2)nc(Nc2ccccc2)n1
InChIInChI=1S/C17H18N6O/c24-12-11-18-15-21-16(19-13-7-3-1-4-8-13)23-17(22-15)20-14-9-5-2-6-10-14/h1-10,24H,11-12H2,(H3,18,19,20,21,22,23)
InChIKeyVBWTXRISKRSIFJ-UHFFFAOYSA-N
XLogP2.76
TPSA94.99 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.37
LogP ≤ 52.76
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

Analyze 2-[(4,6-dianilino-1,3,5-triazin-2-yl)amino]ethanol with MolForge

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Related Compounds

1,3,5-Triazine-2,4-diamine, 6-chloro-N2,N4-diphenyl-
CID 16088
2-Anilino-4,6-DI(4-morpholinyl)-1,3,5-triazine
CID 749680
1,3,5-Triazine-2,4-diamine, 6-(4-morpholinyl)-n2,n4-diphenyl-
CID 780750
Triphenylmelamine
CID 16084
N-Allyl-6-chloro-N'-phenyl-[1,3,5]triazine-2,4-diamine
CID 3107858
N-methyl-N'-phenyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine
CID 2266465
2-[[4-(3-Methylanilino)-6-(1-pyrrolidinyl)-1,3,5-triazin-2-yl]amino]ethanol
CID 3146158
2-[[4-(4-Methylanilino)-6-(1-pyrrolidinyl)-1,3,5-triazin-2-yl]amino]ethanol
CID 23648018
2-[[4-(4-Chloroanilino)-6-(1-pyrrolidinyl)-1,3,5-triazin-2-yl]amino]ethanol
CID 2055451
N-(2-Morpholin-4-yl-ethyl)-N',N''-diphenyl-[1,3,5]triazine-2,4,6-triamine
CID 1095342
2-[4-Chloro-6-(4-isopropyl-phenylamino)-[1,3,5]triazin-2-ylamino]-ethanol
CID 3129759
1-(2-((4,6-Bis(dimethylamino)-1,3,5-triazin-2-yl)oxy)ethyl)-3-phenylurea
CID 658880

Frequently Asked Questions

What is the IUPAC name of 2-[(4,6-dianilino-1,3,5-triazin-2-yl)amino]ethanol?
The IUPAC name of 2-[(4,6-dianilino-1,3,5-triazin-2-yl)amino]ethanol (CID 2195709) is 2-[(4,6-dianilino-1,3,5-triazin-2-yl)amino]ethanol.
What is the SMILES notation for 2-[(4,6-dianilino-1,3,5-triazin-2-yl)amino]ethanol?
The canonical SMILES for 2-[(4,6-dianilino-1,3,5-triazin-2-yl)amino]ethanol is OCCNc1nc(Nc2ccccc2)nc(Nc2ccccc2)n1.
What is the InChIKey of 2-[(4,6-dianilino-1,3,5-triazin-2-yl)amino]ethanol?
The InChIKey is VBWTXRISKRSIFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N6O/c24-12-11-18-15-21-16(19-13-7-3-1-4-8-13)23-17(22-15)20-14-9-5-2-6-10-14/h1-10,24H,11-12H2,(H3,18,19,20,21,22,23).
What are the key properties of 2-[(4,6-dianilino-1,3,5-triazin-2-yl)amino]ethanol?
2-[(4,6-dianilino-1,3,5-triazin-2-yl)amino]ethanol has a molecular weight of 322.37 g/mol, XLogP of 2.76, 7 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4,6-dianilino-1,3,5-triazin-2-yl)amino]ethanol is sourced from PubChem (CID 2195709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).