2-amino-1-pyrazolo[1,5-a]pyrimidin-6-ylpropan-1-one

C9H10N4O — CID 84771473

IUPAC2-amino-1-pyrazolo[1,5-a]pyrimidin-6-ylpropan-1-one
SMILESCC(N)C(=O)c1cnc2ccnn2c1
InChIInChI=1S/C9H10N4O/c1-6(10)9(14)7-4-11-8-2-3-12-13(8)5-7/h2-6H,10H2,1H3
InChIKeyMAOQIAIOSFOZDJ-UHFFFAOYSA-N
MW190.21 g/mol
LogP0.26
Rot. Bonds2

About 2-amino-1-pyrazolo[1,5-a]pyrimidin-6-ylpropan-1-one

2-amino-1-pyrazolo[1,5-a]pyrimidin-6-ylpropan-1-one (PubChem CID 84771473) has the molecular formula C9H10N4O and a molecular weight of 190.21 g/mol. Its IUPAC name is 2-amino-1-pyrazolo[1,5-a]pyrimidin-6-ylpropan-1-one.

Molecular Properties

Compound Name2-amino-1-pyrazolo[1,5-a]pyrimidin-6-ylpropan-1-one
PubChem CID84771473
Molecular FormulaC9H10N4O
Molecular Weight190.21 g/mol
Exact Mass190.09
IUPAC Name2-amino-1-pyrazolo[1,5-a]pyrimidin-6-ylpropan-1-one
SMILESCC(N)C(=O)c1cnc2ccnn2c1
InChIInChI=1S/C9H10N4O/c1-6(10)9(14)7-4-11-8-2-3-12-13(8)5-7/h2-6H,10H2,1H3
InChIKeyMAOQIAIOSFOZDJ-UHFFFAOYSA-N
XLogP0.26
TPSA73.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.21
LogP ≤ 50.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-amino-1-pyrazolo[1,5-a]pyrimidin-6-ylpropan-1-one?
The IUPAC name of 2-amino-1-pyrazolo[1,5-a]pyrimidin-6-ylpropan-1-one (CID 84771473) is 2-amino-1-pyrazolo[1,5-a]pyrimidin-6-ylpropan-1-one.
What is the SMILES notation for 2-amino-1-pyrazolo[1,5-a]pyrimidin-6-ylpropan-1-one?
The canonical SMILES for 2-amino-1-pyrazolo[1,5-a]pyrimidin-6-ylpropan-1-one is CC(N)C(=O)c1cnc2ccnn2c1.
What is the InChIKey of 2-amino-1-pyrazolo[1,5-a]pyrimidin-6-ylpropan-1-one?
The InChIKey is MAOQIAIOSFOZDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4O/c1-6(10)9(14)7-4-11-8-2-3-12-13(8)5-7/h2-6H,10H2,1H3.
What are the key properties of 2-amino-1-pyrazolo[1,5-a]pyrimidin-6-ylpropan-1-one?
2-amino-1-pyrazolo[1,5-a]pyrimidin-6-ylpropan-1-one has a molecular weight of 190.21 g/mol, XLogP of 0.26, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-pyrazolo[1,5-a]pyrimidin-6-ylpropan-1-one is sourced from PubChem (CID 84771473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).