2-(2-methylpropyl)pyrimidin-5-ol

C8H12N2O — CID 83815356

IUPAC2-(2-methylpropyl)pyrimidin-5-ol
SMILESCC(C)Cc1ncc(O)cn1
InChIInChI=1S/C8H12N2O/c1-6(2)3-8-9-4-7(11)5-10-8/h4-6,11H,3H2,1-2H3
InChIKeyPDHTWMDYRSFMLX-UHFFFAOYSA-N
MW152.20 g/mol
LogP1.38
Rot. Bonds2

About 2-(2-methylpropyl)pyrimidin-5-ol

2-(2-methylpropyl)pyrimidin-5-ol (PubChem CID 83815356) has the molecular formula C8H12N2O and a molecular weight of 152.20 g/mol. Its IUPAC name is 2-(2-methylpropyl)pyrimidin-5-ol.

Molecular Properties

Compound Name2-(2-methylpropyl)pyrimidin-5-ol
PubChem CID83815356
Molecular FormulaC8H12N2O
Molecular Weight152.20 g/mol
Exact Mass152.09
IUPAC Name2-(2-methylpropyl)pyrimidin-5-ol
SMILESCC(C)Cc1ncc(O)cn1
InChIInChI=1S/C8H12N2O/c1-6(2)3-8-9-4-7(11)5-10-8/h4-6,11H,3H2,1-2H3
InChIKeyPDHTWMDYRSFMLX-UHFFFAOYSA-N
XLogP1.38
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methylpropyl)pyrimidin-5-ol?
The IUPAC name of 2-(2-methylpropyl)pyrimidin-5-ol (CID 83815356) is 2-(2-methylpropyl)pyrimidin-5-ol.
What is the SMILES notation for 2-(2-methylpropyl)pyrimidin-5-ol?
The canonical SMILES for 2-(2-methylpropyl)pyrimidin-5-ol is CC(C)Cc1ncc(O)cn1.
What is the InChIKey of 2-(2-methylpropyl)pyrimidin-5-ol?
The InChIKey is PDHTWMDYRSFMLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O/c1-6(2)3-8-9-4-7(11)5-10-8/h4-6,11H,3H2,1-2H3.
What are the key properties of 2-(2-methylpropyl)pyrimidin-5-ol?
2-(2-methylpropyl)pyrimidin-5-ol has a molecular weight of 152.20 g/mol, XLogP of 1.38, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylpropyl)pyrimidin-5-ol is sourced from PubChem (CID 83815356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).