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

C7H14N6O2 — CID 11171897

IUPAC2-[[4-amino-6-(2-hydroxyethylamino)-1,3,5-triazin-2-yl]amino]ethanol
SMILESNc1nc(NCCO)nc(NCCO)n1
InChIInChI=1S/C7H14N6O2/c8-5-11-6(9-1-3-14)13-7(12-5)10-2-4-15/h14-15H,1-4H2,(H4,8,9,10,11,12,13)
InChIKeySMCJDZBBLDNQQX-UHFFFAOYSA-N
MW214.23 g/mol
LogP-1.74
Rot. Bonds6

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

2-[[4-amino-6-(2-hydroxyethylamino)-1,3,5-triazin-2-yl]amino]ethanol (PubChem CID 11171897) has the molecular formula C7H14N6O2 and a molecular weight of 214.23 g/mol. Its IUPAC name is 2-[[4-amino-6-(2-hydroxyethylamino)-1,3,5-triazin-2-yl]amino]ethanol.

Molecular Properties

Compound Name2-[[4-amino-6-(2-hydroxyethylamino)-1,3,5-triazin-2-yl]amino]ethanol
PubChem CID11171897
Molecular FormulaC7H14N6O2
Molecular Weight214.23 g/mol
Exact Mass214.12
IUPAC Name2-[[4-amino-6-(2-hydroxyethylamino)-1,3,5-triazin-2-yl]amino]ethanol
SMILESNc1nc(NCCO)nc(NCCO)n1
InChIInChI=1S/C7H14N6O2/c8-5-11-6(9-1-3-14)13-7(12-5)10-2-4-15/h14-15H,1-4H2,(H4,8,9,10,11,12,13)
InChIKeySMCJDZBBLDNQQX-UHFFFAOYSA-N
XLogP-1.74
TPSA129.21 Ų
H-Bond Donors5
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.23
LogP ≤ 5-1.74
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 2-[[4-amino-6-(2-hydroxyethylamino)-1,3,5-triazin-2-yl]amino]ethanol?
The IUPAC name of 2-[[4-amino-6-(2-hydroxyethylamino)-1,3,5-triazin-2-yl]amino]ethanol (CID 11171897) is 2-[[4-amino-6-(2-hydroxyethylamino)-1,3,5-triazin-2-yl]amino]ethanol.
What is the SMILES notation for 2-[[4-amino-6-(2-hydroxyethylamino)-1,3,5-triazin-2-yl]amino]ethanol?
The canonical SMILES for 2-[[4-amino-6-(2-hydroxyethylamino)-1,3,5-triazin-2-yl]amino]ethanol is Nc1nc(NCCO)nc(NCCO)n1.
What is the InChIKey of 2-[[4-amino-6-(2-hydroxyethylamino)-1,3,5-triazin-2-yl]amino]ethanol?
The InChIKey is SMCJDZBBLDNQQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N6O2/c8-5-11-6(9-1-3-14)13-7(12-5)10-2-4-15/h14-15H,1-4H2,(H4,8,9,10,11,12,13).
What are the key properties of 2-[[4-amino-6-(2-hydroxyethylamino)-1,3,5-triazin-2-yl]amino]ethanol?
2-[[4-amino-6-(2-hydroxyethylamino)-1,3,5-triazin-2-yl]amino]ethanol has a molecular weight of 214.23 g/mol, XLogP of -1.74, 6 rotatable bonds, 5 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4-amino-6-(2-hydroxyethylamino)-1,3,5-triazin-2-yl]amino]ethanol is sourced from PubChem (CID 11171897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).