2-[[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]-2-ethylpropane-1,3-diol

C11H22N6O2 — CID 107868608

IUPAC2-[[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]-2-ethylpropane-1,3-diol
SMILESCCC(CO)(CO)Nc1nc(NC)nc(N(C)C)n1
InChIInChI=1S/C11H22N6O2/c1-5-11(6-18,7-19)16-9-13-8(12-2)14-10(15-9)17(3)4/h18-19H,5-7H2,1-4H3,(H2,12,13,14,15,16)
InChIKeyPDSPTUYTWFGGHA-UHFFFAOYSA-N
MW270.34 g/mol
LogP-0.48
Rot. Bonds7

About 2-[[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]-2-ethylpropane-1,3-diol

2-[[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]-2-ethylpropane-1,3-diol (PubChem CID 107868608) has the molecular formula C11H22N6O2 and a molecular weight of 270.34 g/mol. Its IUPAC name is 2-[[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]-2-ethylpropane-1,3-diol.

Molecular Properties

Compound Name2-[[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]-2-ethylpropane-1,3-diol
PubChem CID107868608
Molecular FormulaC11H22N6O2
Molecular Weight270.34 g/mol
Exact Mass270.18
IUPAC Name2-[[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]-2-ethylpropane-1,3-diol
SMILESCCC(CO)(CO)Nc1nc(NC)nc(N(C)C)n1
InChIInChI=1S/C11H22N6O2/c1-5-11(6-18,7-19)16-9-13-8(12-2)14-10(15-9)17(3)4/h18-19H,5-7H2,1-4H3,(H2,12,13,14,15,16)
InChIKeyPDSPTUYTWFGGHA-UHFFFAOYSA-N
XLogP-0.48
TPSA106.43 Ų
H-Bond Donors4
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 5-0.48
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 108

Analyze 2-[[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]-2-ethylpropane-1,3-diol with MolForge

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Related Compounds

2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-2-ethylpropane-1,3-diol
CID 107868692
2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-2-ethylbutan-1-ol
CID 80831979
2-ethyl-2-[[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]propane-1,3-diol
CID 107868576
2-[[4-chloro-6-(methylamino)-1,3,5-triazin-2-yl]amino]-2-(hydroxymethyl)propane-1,3-diol
CID 114009564
2-[[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]-methylamino]propan-1-ol
CID 113426550
3-[[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]sulfanyl]propan-1-ol
CID 80890214
2-N-(3-ethylpentan-3-yl)-6-methoxy-4-N-methyl-1,3,5-triazine-2,4-diamine
CID 80840573
3-[[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]-2-methylpropan-1-ol
CID 80841297
2-N,4-N,4-N,6-N-tetramethyl-2-N-propyl-1,3,5-triazine-2,4,6-triamine
CID 80774094
1-(dimethylamino)-3-[[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]-2-methylpropan-2-ol
CID 106150231
3-[[4-(dimethylamino)-6-(ethylamino)-1,3,5-triazin-2-yl]amino]-2,2-difluoropropan-1-ol
CID 106179421
2-N,2-N,4-N-trimethyl-6-propylsulfanyl-1,3,5-triazine-2,4-diamine
CID 80887563

Frequently Asked Questions

What is the IUPAC name of 2-[[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]-2-ethylpropane-1,3-diol?
The IUPAC name of 2-[[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]-2-ethylpropane-1,3-diol (CID 107868608) is 2-[[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]-2-ethylpropane-1,3-diol.
What is the SMILES notation for 2-[[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]-2-ethylpropane-1,3-diol?
The canonical SMILES for 2-[[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]-2-ethylpropane-1,3-diol is CCC(CO)(CO)Nc1nc(NC)nc(N(C)C)n1.
What is the InChIKey of 2-[[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]-2-ethylpropane-1,3-diol?
The InChIKey is PDSPTUYTWFGGHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N6O2/c1-5-11(6-18,7-19)16-9-13-8(12-2)14-10(15-9)17(3)4/h18-19H,5-7H2,1-4H3,(H2,12,13,14,15,16).
What are the key properties of 2-[[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]-2-ethylpropane-1,3-diol?
2-[[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]-2-ethylpropane-1,3-diol has a molecular weight of 270.34 g/mol, XLogP of -0.48, 7 rotatable bonds, 4 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]-2-ethylpropane-1,3-diol is sourced from PubChem (CID 107868608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).