pyrazolo[1,5-a]pyrimidin-2-yl-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

C15H15N7O — CID 74233841

IUPACpyrazolo[1,5-a]pyrimidin-2-yl-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
SMILESO=C(c1cc2ncccn2n1)N1CCN(c2ncccn2)CC1
InChIInChI=1S/C15H15N7O/c23-14(12-11-13-16-5-2-6-22(13)19-12)20-7-9-21(10-8-20)15-17-3-1-4-18-15/h1-6,11H,7-10H2
InChIKeyOMXXDXQUIWSCMO-UHFFFAOYSA-N
MW309.33 g/mol
LogP0.48
Rot. Bonds2

About pyrazolo[1,5-a]pyrimidin-2-yl-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

pyrazolo[1,5-a]pyrimidin-2-yl-(4-pyrimidin-2-ylpiperazin-1-yl)methanone (PubChem CID 74233841) has the molecular formula C15H15N7O and a molecular weight of 309.33 g/mol. Its IUPAC name is pyrazolo[1,5-a]pyrimidin-2-yl-(4-pyrimidin-2-ylpiperazin-1-yl)methanone.

Molecular Properties

Compound Namepyrazolo[1,5-a]pyrimidin-2-yl-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
PubChem CID74233841
Molecular FormulaC15H15N7O
Molecular Weight309.33 g/mol
Exact Mass309.13
IUPAC Namepyrazolo[1,5-a]pyrimidin-2-yl-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
SMILESO=C(c1cc2ncccn2n1)N1CCN(c2ncccn2)CC1
InChIInChI=1S/C15H15N7O/c23-14(12-11-13-16-5-2-6-22(13)19-12)20-7-9-21(10-8-20)15-17-3-1-4-18-15/h1-6,11H,7-10H2
InChIKeyOMXXDXQUIWSCMO-UHFFFAOYSA-N
XLogP0.48
TPSA79.52 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.33
LogP ≤ 50.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of pyrazolo[1,5-a]pyrimidin-2-yl-(4-pyrimidin-2-ylpiperazin-1-yl)methanone?
The IUPAC name of pyrazolo[1,5-a]pyrimidin-2-yl-(4-pyrimidin-2-ylpiperazin-1-yl)methanone (CID 74233841) is pyrazolo[1,5-a]pyrimidin-2-yl-(4-pyrimidin-2-ylpiperazin-1-yl)methanone.
What is the SMILES notation for pyrazolo[1,5-a]pyrimidin-2-yl-(4-pyrimidin-2-ylpiperazin-1-yl)methanone?
The canonical SMILES for pyrazolo[1,5-a]pyrimidin-2-yl-(4-pyrimidin-2-ylpiperazin-1-yl)methanone is O=C(c1cc2ncccn2n1)N1CCN(c2ncccn2)CC1.
What is the InChIKey of pyrazolo[1,5-a]pyrimidin-2-yl-(4-pyrimidin-2-ylpiperazin-1-yl)methanone?
The InChIKey is OMXXDXQUIWSCMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N7O/c23-14(12-11-13-16-5-2-6-22(13)19-12)20-7-9-21(10-8-20)15-17-3-1-4-18-15/h1-6,11H,7-10H2.
What are the key properties of pyrazolo[1,5-a]pyrimidin-2-yl-(4-pyrimidin-2-ylpiperazin-1-yl)methanone?
pyrazolo[1,5-a]pyrimidin-2-yl-(4-pyrimidin-2-ylpiperazin-1-yl)methanone has a molecular weight of 309.33 g/mol, XLogP of 0.48, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for pyrazolo[1,5-a]pyrimidin-2-yl-(4-pyrimidin-2-ylpiperazin-1-yl)methanone is sourced from PubChem (CID 74233841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).