1-(6-fluoroimidazo[1,2-a]pyrimidin-2-yl)-2-methylpropan-1-one

C10H10FN3O — CID 123829652

IUPAC1-(6-fluoroimidazo[1,2-a]pyrimidin-2-yl)-2-methylpropan-1-one
SMILESCC(C)C(=O)c1cn2cc(F)cnc2n1
InChIInChI=1S/C10H10FN3O/c1-6(2)9(15)8-5-14-4-7(11)3-12-10(14)13-8/h3-6H,1-2H3
InChIKeyPJCCNFWLJILJDC-UHFFFAOYSA-N
MW207.21 g/mol
LogP1.71
Rot. Bonds2

About 1-(6-fluoroimidazo[1,2-a]pyrimidin-2-yl)-2-methylpropan-1-one

1-(6-fluoroimidazo[1,2-a]pyrimidin-2-yl)-2-methylpropan-1-one (PubChem CID 123829652) has the molecular formula C10H10FN3O and a molecular weight of 207.21 g/mol. Its IUPAC name is 1-(6-fluoroimidazo[1,2-a]pyrimidin-2-yl)-2-methylpropan-1-one.

Molecular Properties

Compound Name1-(6-fluoroimidazo[1,2-a]pyrimidin-2-yl)-2-methylpropan-1-one
PubChem CID123829652
Molecular FormulaC10H10FN3O
Molecular Weight207.21 g/mol
Exact Mass207.08
IUPAC Name1-(6-fluoroimidazo[1,2-a]pyrimidin-2-yl)-2-methylpropan-1-one
SMILESCC(C)C(=O)c1cn2cc(F)cnc2n1
InChIInChI=1S/C10H10FN3O/c1-6(2)9(15)8-5-14-4-7(11)3-12-10(14)13-8/h3-6H,1-2H3
InChIKeyPJCCNFWLJILJDC-UHFFFAOYSA-N
XLogP1.71
TPSA47.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.21
LogP ≤ 51.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(6-fluoroimidazo[1,2-a]pyrimidin-2-yl)-2-methylpropan-1-one?
The IUPAC name of 1-(6-fluoroimidazo[1,2-a]pyrimidin-2-yl)-2-methylpropan-1-one (CID 123829652) is 1-(6-fluoroimidazo[1,2-a]pyrimidin-2-yl)-2-methylpropan-1-one.
What is the SMILES notation for 1-(6-fluoroimidazo[1,2-a]pyrimidin-2-yl)-2-methylpropan-1-one?
The canonical SMILES for 1-(6-fluoroimidazo[1,2-a]pyrimidin-2-yl)-2-methylpropan-1-one is CC(C)C(=O)c1cn2cc(F)cnc2n1.
What is the InChIKey of 1-(6-fluoroimidazo[1,2-a]pyrimidin-2-yl)-2-methylpropan-1-one?
The InChIKey is PJCCNFWLJILJDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FN3O/c1-6(2)9(15)8-5-14-4-7(11)3-12-10(14)13-8/h3-6H,1-2H3.
What are the key properties of 1-(6-fluoroimidazo[1,2-a]pyrimidin-2-yl)-2-methylpropan-1-one?
1-(6-fluoroimidazo[1,2-a]pyrimidin-2-yl)-2-methylpropan-1-one has a molecular weight of 207.21 g/mol, XLogP of 1.71, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-fluoroimidazo[1,2-a]pyrimidin-2-yl)-2-methylpropan-1-one is sourced from PubChem (CID 123829652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).