2-(2-aminopyrimidin-4-yl)ethanol

C6H9N3O — CID 22444209

IUPAC2-(2-aminopyrimidin-4-yl)ethanol
SMILESNc1nccc(CCO)n1
InChIInChI=1S/C6H9N3O/c7-6-8-3-1-5(9-6)2-4-10/h1,3,10H,2,4H2,(H2,7,8,9)
InChIKeyLOZKMMHGSINGLY-UHFFFAOYSA-N
MW139.16 g/mol
LogP-0.41
Rot. Bonds2

About 2-(2-aminopyrimidin-4-yl)ethanol

2-(2-aminopyrimidin-4-yl)ethanol (PubChem CID 22444209) has the molecular formula C6H9N3O and a molecular weight of 139.16 g/mol. Its IUPAC name is 2-(2-aminopyrimidin-4-yl)ethanol.

Molecular Properties

Compound Name2-(2-aminopyrimidin-4-yl)ethanol
PubChem CID22444209
Molecular FormulaC6H9N3O
Molecular Weight139.16 g/mol
Exact Mass139.07
IUPAC Name2-(2-aminopyrimidin-4-yl)ethanol
SMILESNc1nccc(CCO)n1
InChIInChI=1S/C6H9N3O/c7-6-8-3-1-5(9-6)2-4-10/h1,3,10H,2,4H2,(H2,7,8,9)
InChIKeyLOZKMMHGSINGLY-UHFFFAOYSA-N
XLogP-0.41
TPSA72.03 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.16
LogP ≤ 5-0.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-aminopyrimidin-4-yl)ethanol?
The IUPAC name of 2-(2-aminopyrimidin-4-yl)ethanol (CID 22444209) is 2-(2-aminopyrimidin-4-yl)ethanol.
What is the SMILES notation for 2-(2-aminopyrimidin-4-yl)ethanol?
The canonical SMILES for 2-(2-aminopyrimidin-4-yl)ethanol is Nc1nccc(CCO)n1.
What is the InChIKey of 2-(2-aminopyrimidin-4-yl)ethanol?
The InChIKey is LOZKMMHGSINGLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O/c7-6-8-3-1-5(9-6)2-4-10/h1,3,10H,2,4H2,(H2,7,8,9).
What are the key properties of 2-(2-aminopyrimidin-4-yl)ethanol?
2-(2-aminopyrimidin-4-yl)ethanol has a molecular weight of 139.16 g/mol, XLogP of -0.41, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminopyrimidin-4-yl)ethanol is sourced from PubChem (CID 22444209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).