6-propan-2-ylimidazo[1,2-a]pyrimidin-3-ol

C9H11N3O — CID 105436848

IUPAC6-propan-2-ylimidazo[1,2-a]pyrimidin-3-ol
SMILESCC(C)c1cnc2ncc(O)n2c1
InChIInChI=1S/C9H11N3O/c1-6(2)7-3-10-9-11-4-8(13)12(9)5-7/h3-6,13H,1-2H3
InChIKeyPLUVKLRPBZHEQD-UHFFFAOYSA-N
MW177.21 g/mol
LogP1.56
Rot. Bonds1

About 6-propan-2-ylimidazo[1,2-a]pyrimidin-3-ol

6-propan-2-ylimidazo[1,2-a]pyrimidin-3-ol (PubChem CID 105436848) has the molecular formula C9H11N3O and a molecular weight of 177.21 g/mol. Its IUPAC name is 6-propan-2-ylimidazo[1,2-a]pyrimidin-3-ol.

Molecular Properties

Compound Name6-propan-2-ylimidazo[1,2-a]pyrimidin-3-ol
PubChem CID105436848
Molecular FormulaC9H11N3O
Molecular Weight177.21 g/mol
Exact Mass177.09
IUPAC Name6-propan-2-ylimidazo[1,2-a]pyrimidin-3-ol
SMILESCC(C)c1cnc2ncc(O)n2c1
InChIInChI=1S/C9H11N3O/c1-6(2)7-3-10-9-11-4-8(13)12(9)5-7/h3-6,13H,1-2H3
InChIKeyPLUVKLRPBZHEQD-UHFFFAOYSA-N
XLogP1.56
TPSA50.42 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.21
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-propan-2-ylimidazo[1,2-a]pyrimidin-3-ol?
The IUPAC name of 6-propan-2-ylimidazo[1,2-a]pyrimidin-3-ol (CID 105436848) is 6-propan-2-ylimidazo[1,2-a]pyrimidin-3-ol.
What is the SMILES notation for 6-propan-2-ylimidazo[1,2-a]pyrimidin-3-ol?
The canonical SMILES for 6-propan-2-ylimidazo[1,2-a]pyrimidin-3-ol is CC(C)c1cnc2ncc(O)n2c1.
What is the InChIKey of 6-propan-2-ylimidazo[1,2-a]pyrimidin-3-ol?
The InChIKey is PLUVKLRPBZHEQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O/c1-6(2)7-3-10-9-11-4-8(13)12(9)5-7/h3-6,13H,1-2H3.
What are the key properties of 6-propan-2-ylimidazo[1,2-a]pyrimidin-3-ol?
6-propan-2-ylimidazo[1,2-a]pyrimidin-3-ol has a molecular weight of 177.21 g/mol, XLogP of 1.56, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-propan-2-ylimidazo[1,2-a]pyrimidin-3-ol is sourced from PubChem (CID 105436848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).