2-pyrimidin-5-ylpropan-2-ol

C7H10N2O — CID 14434909

IUPAC2-pyrimidin-5-ylpropan-2-ol
SMILESCC(C)(O)c1cncnc1
InChIInChI=1S/C7H10N2O/c1-7(2,10)6-3-8-5-9-4-6/h3-5,10H,1-2H3
InChIKeyOTTNMYLFYRNEIK-UHFFFAOYSA-N
MW138.17 g/mol
LogP0.70
Rot. Bonds1

About 2-pyrimidin-5-ylpropan-2-ol

2-pyrimidin-5-ylpropan-2-ol (PubChem CID 14434909) has the molecular formula C7H10N2O and a molecular weight of 138.17 g/mol. Its IUPAC name is 2-pyrimidin-5-ylpropan-2-ol.

Molecular Properties

Compound Name2-pyrimidin-5-ylpropan-2-ol
PubChem CID14434909
Molecular FormulaC7H10N2O
Molecular Weight138.17 g/mol
Exact Mass138.08
IUPAC Name2-pyrimidin-5-ylpropan-2-ol
SMILESCC(C)(O)c1cncnc1
InChIInChI=1S/C7H10N2O/c1-7(2,10)6-3-8-5-9-4-6/h3-5,10H,1-2H3
InChIKeyOTTNMYLFYRNEIK-UHFFFAOYSA-N
XLogP0.70
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-pyrimidin-5-ylpropan-2-ol?
The IUPAC name of 2-pyrimidin-5-ylpropan-2-ol (CID 14434909) is 2-pyrimidin-5-ylpropan-2-ol.
What is the SMILES notation for 2-pyrimidin-5-ylpropan-2-ol?
The canonical SMILES for 2-pyrimidin-5-ylpropan-2-ol is CC(C)(O)c1cncnc1.
What is the InChIKey of 2-pyrimidin-5-ylpropan-2-ol?
The InChIKey is OTTNMYLFYRNEIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O/c1-7(2,10)6-3-8-5-9-4-6/h3-5,10H,1-2H3.
What are the key properties of 2-pyrimidin-5-ylpropan-2-ol?
2-pyrimidin-5-ylpropan-2-ol has a molecular weight of 138.17 g/mol, XLogP of 0.70, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyrimidin-5-ylpropan-2-ol is sourced from PubChem (CID 14434909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).