2-pyrimidin-4-ylethanol

C6H8N2O — CID 15475344

IUPAC2-pyrimidin-4-ylethanol
SMILESOCCc1ccncn1
InChIInChI=1S/C6H8N2O/c9-4-2-6-1-3-7-5-8-6/h1,3,5,9H,2,4H2
InChIKeyBOVUIYOURRNFKZ-UHFFFAOYSA-N
MW124.14 g/mol
LogP0.01
Rot. Bonds2

About 2-pyrimidin-4-ylethanol

2-pyrimidin-4-ylethanol (PubChem CID 15475344) has the molecular formula C6H8N2O and a molecular weight of 124.14 g/mol. Its IUPAC name is 2-pyrimidin-4-ylethanol.

Molecular Properties

Compound Name2-pyrimidin-4-ylethanol
PubChem CID15475344
Molecular FormulaC6H8N2O
Molecular Weight124.14 g/mol
Exact Mass124.06
IUPAC Name2-pyrimidin-4-ylethanol
SMILESOCCc1ccncn1
InChIInChI=1S/C6H8N2O/c9-4-2-6-1-3-7-5-8-6/h1,3,5,9H,2,4H2
InChIKeyBOVUIYOURRNFKZ-UHFFFAOYSA-N
XLogP0.01
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.14
LogP ≤ 50.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-pyrimidin-4-ylethanol?
The IUPAC name of 2-pyrimidin-4-ylethanol (CID 15475344) is 2-pyrimidin-4-ylethanol.
What is the SMILES notation for 2-pyrimidin-4-ylethanol?
The canonical SMILES for 2-pyrimidin-4-ylethanol is OCCc1ccncn1.
What is the InChIKey of 2-pyrimidin-4-ylethanol?
The InChIKey is BOVUIYOURRNFKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O/c9-4-2-6-1-3-7-5-8-6/h1,3,5,9H,2,4H2.
What are the key properties of 2-pyrimidin-4-ylethanol?
2-pyrimidin-4-ylethanol has a molecular weight of 124.14 g/mol, XLogP of 0.01, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyrimidin-4-ylethanol is sourced from PubChem (CID 15475344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).