2-(6-aminopyrimidin-4-yl)oxyethanol

C6H9N3O2 — CID 18931069

IUPAC2-(6-aminopyrimidin-4-yl)oxyethanol
SMILESNc1cc(OCCO)ncn1
InChIInChI=1S/C6H9N3O2/c7-5-3-6(9-4-8-5)11-2-1-10/h3-4,10H,1-2H2,(H2,7,8,9)
InChIKeyZZNRDBBAQJBTGK-UHFFFAOYSA-N
MW155.16 g/mol
LogP-0.57
Rot. Bonds3

About 2-(6-aminopyrimidin-4-yl)oxyethanol

2-(6-aminopyrimidin-4-yl)oxyethanol (PubChem CID 18931069) has the molecular formula C6H9N3O2 and a molecular weight of 155.16 g/mol. Its IUPAC name is 2-(6-aminopyrimidin-4-yl)oxyethanol.

Molecular Properties

Compound Name2-(6-aminopyrimidin-4-yl)oxyethanol
PubChem CID18931069
Molecular FormulaC6H9N3O2
Molecular Weight155.16 g/mol
Exact Mass155.07
IUPAC Name2-(6-aminopyrimidin-4-yl)oxyethanol
SMILESNc1cc(OCCO)ncn1
InChIInChI=1S/C6H9N3O2/c7-5-3-6(9-4-8-5)11-2-1-10/h3-4,10H,1-2H2,(H2,7,8,9)
InChIKeyZZNRDBBAQJBTGK-UHFFFAOYSA-N
XLogP-0.57
TPSA81.26 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.16
LogP ≤ 5-0.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(6-aminopyrimidin-4-yl)oxyethanol?
The IUPAC name of 2-(6-aminopyrimidin-4-yl)oxyethanol (CID 18931069) is 2-(6-aminopyrimidin-4-yl)oxyethanol.
What is the SMILES notation for 2-(6-aminopyrimidin-4-yl)oxyethanol?
The canonical SMILES for 2-(6-aminopyrimidin-4-yl)oxyethanol is Nc1cc(OCCO)ncn1.
What is the InChIKey of 2-(6-aminopyrimidin-4-yl)oxyethanol?
The InChIKey is ZZNRDBBAQJBTGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O2/c7-5-3-6(9-4-8-5)11-2-1-10/h3-4,10H,1-2H2,(H2,7,8,9).
What are the key properties of 2-(6-aminopyrimidin-4-yl)oxyethanol?
2-(6-aminopyrimidin-4-yl)oxyethanol has a molecular weight of 155.16 g/mol, XLogP of -0.57, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-aminopyrimidin-4-yl)oxyethanol is sourced from PubChem (CID 18931069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).