5-[4-(1,3-oxazol-2-yl)phenyl]-3-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one

C20H13N5O2 — CID 70925459

IUPAC5-[4-(1,3-oxazol-2-yl)phenyl]-3-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
SMILESO=c1cc(-c2ccc(-c3ncco3)cc2)nc2c(-c3ccccn3)c[nH]n12
InChIInChI=1S/C20H13N5O2/c26-18-11-17(13-4-6-14(7-5-13)20-22-9-10-27-20)24-19-15(12-23-25(18)19)16-3-1-2-8-21-16/h1-12,23H
InChIKeyUYHWOGXSGWRODW-UHFFFAOYSA-N
MW355.36 g/mol
LogP3.41
Rot. Bonds3

About 5-[4-(1,3-oxazol-2-yl)phenyl]-3-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one

5-[4-(1,3-oxazol-2-yl)phenyl]-3-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one (PubChem CID 70925459) has the molecular formula C20H13N5O2 and a molecular weight of 355.36 g/mol. Its IUPAC name is 5-[4-(1,3-oxazol-2-yl)phenyl]-3-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one.

Molecular Properties

Compound Name5-[4-(1,3-oxazol-2-yl)phenyl]-3-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
PubChem CID70925459
Molecular FormulaC20H13N5O2
Molecular Weight355.36 g/mol
Exact Mass355.11
IUPAC Name5-[4-(1,3-oxazol-2-yl)phenyl]-3-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
SMILESO=c1cc(-c2ccc(-c3ncco3)cc2)nc2c(-c3ccccn3)c[nH]n12
InChIInChI=1S/C20H13N5O2/c26-18-11-17(13-4-6-14(7-5-13)20-22-9-10-27-20)24-19-15(12-23-25(18)19)16-3-1-2-8-21-16/h1-12,23H
InChIKeyUYHWOGXSGWRODW-UHFFFAOYSA-N
XLogP3.41
TPSA89.08 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.36
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-[4-(1,3-oxazol-2-yl)phenyl]-3-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The IUPAC name of 5-[4-(1,3-oxazol-2-yl)phenyl]-3-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one (CID 70925459) is 5-[4-(1,3-oxazol-2-yl)phenyl]-3-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one.
What is the SMILES notation for 5-[4-(1,3-oxazol-2-yl)phenyl]-3-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The canonical SMILES for 5-[4-(1,3-oxazol-2-yl)phenyl]-3-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one is O=c1cc(-c2ccc(-c3ncco3)cc2)nc2c(-c3ccccn3)c[nH]n12.
What is the InChIKey of 5-[4-(1,3-oxazol-2-yl)phenyl]-3-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The InChIKey is UYHWOGXSGWRODW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H13N5O2/c26-18-11-17(13-4-6-14(7-5-13)20-22-9-10-27-20)24-19-15(12-23-25(18)19)16-3-1-2-8-21-16/h1-12,23H.
What are the key properties of 5-[4-(1,3-oxazol-2-yl)phenyl]-3-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
5-[4-(1,3-oxazol-2-yl)phenyl]-3-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one has a molecular weight of 355.36 g/mol, XLogP of 3.41, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-(1,3-oxazol-2-yl)phenyl]-3-pyridin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one is sourced from PubChem (CID 70925459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).