4,6-dimethyl-2-propylpyrimidin-5-ol

C9H14N2O — CID 13173530

IUPAC4,6-dimethyl-2-propylpyrimidin-5-ol
SMILESCCCc1nc(C)c(O)c(C)n1
InChIInChI=1S/C9H14N2O/c1-4-5-8-10-6(2)9(12)7(3)11-8/h12H,4-5H2,1-3H3
InChIKeyGVOBICZMHFFYNK-UHFFFAOYSA-N
MW166.22 g/mol
LogP1.75
Rot. Bonds2

About 4,6-dimethyl-2-propylpyrimidin-5-ol

4,6-dimethyl-2-propylpyrimidin-5-ol (PubChem CID 13173530) has the molecular formula C9H14N2O and a molecular weight of 166.22 g/mol. Its IUPAC name is 4,6-dimethyl-2-propylpyrimidin-5-ol.

Molecular Properties

Compound Name4,6-dimethyl-2-propylpyrimidin-5-ol
PubChem CID13173530
Molecular FormulaC9H14N2O
Molecular Weight166.22 g/mol
Exact Mass166.11
IUPAC Name4,6-dimethyl-2-propylpyrimidin-5-ol
SMILESCCCc1nc(C)c(O)c(C)n1
InChIInChI=1S/C9H14N2O/c1-4-5-8-10-6(2)9(12)7(3)11-8/h12H,4-5H2,1-3H3
InChIKeyGVOBICZMHFFYNK-UHFFFAOYSA-N
XLogP1.75
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4,6-dimethyl-2-propylpyrimidin-5-ol?
The IUPAC name of 4,6-dimethyl-2-propylpyrimidin-5-ol (CID 13173530) is 4,6-dimethyl-2-propylpyrimidin-5-ol.
What is the SMILES notation for 4,6-dimethyl-2-propylpyrimidin-5-ol?
The canonical SMILES for 4,6-dimethyl-2-propylpyrimidin-5-ol is CCCc1nc(C)c(O)c(C)n1.
What is the InChIKey of 4,6-dimethyl-2-propylpyrimidin-5-ol?
The InChIKey is GVOBICZMHFFYNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O/c1-4-5-8-10-6(2)9(12)7(3)11-8/h12H,4-5H2,1-3H3.
What are the key properties of 4,6-dimethyl-2-propylpyrimidin-5-ol?
4,6-dimethyl-2-propylpyrimidin-5-ol has a molecular weight of 166.22 g/mol, XLogP of 1.75, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethyl-2-propylpyrimidin-5-ol is sourced from PubChem (CID 13173530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).