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

C6H10N4O3 — CID 80859663

IUPAC2-[(4-amino-6-methoxy-1,3,5-triazin-2-yl)oxy]ethanol
SMILESCOc1nc(N)nc(OCCO)n1
InChIInChI=1S/C6H10N4O3/c1-12-5-8-4(7)9-6(10-5)13-3-2-11/h11H,2-3H2,1H3,(H2,7,8,9,10)
InChIKeyUOBQBEGMSORZRL-UHFFFAOYSA-N
MW186.17 g/mol
LogP-1.17
Rot. Bonds4

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

2-[(4-amino-6-methoxy-1,3,5-triazin-2-yl)oxy]ethanol (PubChem CID 80859663) has the molecular formula C6H10N4O3 and a molecular weight of 186.17 g/mol. Its IUPAC name is 2-[(4-amino-6-methoxy-1,3,5-triazin-2-yl)oxy]ethanol.

Molecular Properties

Compound Name2-[(4-amino-6-methoxy-1,3,5-triazin-2-yl)oxy]ethanol
PubChem CID80859663
Molecular FormulaC6H10N4O3
Molecular Weight186.17 g/mol
Exact Mass186.08
IUPAC Name2-[(4-amino-6-methoxy-1,3,5-triazin-2-yl)oxy]ethanol
SMILESCOc1nc(N)nc(OCCO)n1
InChIInChI=1S/C6H10N4O3/c1-12-5-8-4(7)9-6(10-5)13-3-2-11/h11H,2-3H2,1H3,(H2,7,8,9,10)
InChIKeyUOBQBEGMSORZRL-UHFFFAOYSA-N
XLogP-1.17
TPSA103.38 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.17
LogP ≤ 5-1.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-amino-6-methoxy-1,3,5-triazin-2-yl)oxy]ethanol?
The IUPAC name of 2-[(4-amino-6-methoxy-1,3,5-triazin-2-yl)oxy]ethanol (CID 80859663) is 2-[(4-amino-6-methoxy-1,3,5-triazin-2-yl)oxy]ethanol.
What is the SMILES notation for 2-[(4-amino-6-methoxy-1,3,5-triazin-2-yl)oxy]ethanol?
The canonical SMILES for 2-[(4-amino-6-methoxy-1,3,5-triazin-2-yl)oxy]ethanol is COc1nc(N)nc(OCCO)n1.
What is the InChIKey of 2-[(4-amino-6-methoxy-1,3,5-triazin-2-yl)oxy]ethanol?
The InChIKey is UOBQBEGMSORZRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N4O3/c1-12-5-8-4(7)9-6(10-5)13-3-2-11/h11H,2-3H2,1H3,(H2,7,8,9,10).
What are the key properties of 2-[(4-amino-6-methoxy-1,3,5-triazin-2-yl)oxy]ethanol?
2-[(4-amino-6-methoxy-1,3,5-triazin-2-yl)oxy]ethanol has a molecular weight of 186.17 g/mol, XLogP of -1.17, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-amino-6-methoxy-1,3,5-triazin-2-yl)oxy]ethanol is sourced from PubChem (CID 80859663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).