[2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]cyclopentyl]methanol

C11H20N6O — CID 106368117

IUPAC[2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]cyclopentyl]methanol
SMILESCN(C)c1nc(N)nc(NC2CCCC2CO)n1
InChIInChI=1S/C11H20N6O/c1-17(2)11-15-9(12)14-10(16-11)13-8-5-3-4-7(8)6-18/h7-8,18H,3-6H2,1-2H3,(H3,12,13,14,15,16)
InChIKeyJYXUEUMMZBEYGH-UHFFFAOYSA-N
MW252.32 g/mol
LogP0.09
Rot. Bonds4

About [2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]cyclopentyl]methanol

[2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]cyclopentyl]methanol (PubChem CID 106368117) has the molecular formula C11H20N6O and a molecular weight of 252.32 g/mol. Its IUPAC name is [2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]cyclopentyl]methanol.

Molecular Properties

Compound Name[2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]cyclopentyl]methanol
PubChem CID106368117
Molecular FormulaC11H20N6O
Molecular Weight252.32 g/mol
Exact Mass252.17
IUPAC Name[2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]cyclopentyl]methanol
SMILESCN(C)c1nc(N)nc(NC2CCCC2CO)n1
InChIInChI=1S/C11H20N6O/c1-17(2)11-15-9(12)14-10(16-11)13-8-5-3-4-7(8)6-18/h7-8,18H,3-6H2,1-2H3,(H3,12,13,14,15,16)
InChIKeyJYXUEUMMZBEYGH-UHFFFAOYSA-N
XLogP0.09
TPSA100.19 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 50.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of [2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]cyclopentyl]methanol?
The IUPAC name of [2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]cyclopentyl]methanol (CID 106368117) is [2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]cyclopentyl]methanol.
What is the SMILES notation for [2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]cyclopentyl]methanol?
The canonical SMILES for [2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]cyclopentyl]methanol is CN(C)c1nc(N)nc(NC2CCCC2CO)n1.
What is the InChIKey of [2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]cyclopentyl]methanol?
The InChIKey is JYXUEUMMZBEYGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N6O/c1-17(2)11-15-9(12)14-10(16-11)13-8-5-3-4-7(8)6-18/h7-8,18H,3-6H2,1-2H3,(H3,12,13,14,15,16).
What are the key properties of [2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]cyclopentyl]methanol?
[2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]cyclopentyl]methanol has a molecular weight of 252.32 g/mol, XLogP of 0.09, 4 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]cyclopentyl]methanol is sourced from PubChem (CID 106368117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).