6-amino-2-pyridin-4-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one

C11H9N5O — CID 82271709

IUPAC6-amino-2-pyridin-4-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
SMILESNc1cnc2cc(-c3ccncc3)[nH]n2c1=O
InChIInChI=1S/C11H9N5O/c12-8-6-14-10-5-9(15-16(10)11(8)17)7-1-3-13-4-2-7/h1-6,15H,12H2
InChIKeySVEXGSDTMPAHDI-UHFFFAOYSA-N
MW227.23 g/mol
LogP0.67
Rot. Bonds1

About 6-amino-2-pyridin-4-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one

6-amino-2-pyridin-4-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one (PubChem CID 82271709) has the molecular formula C11H9N5O and a molecular weight of 227.23 g/mol. Its IUPAC name is 6-amino-2-pyridin-4-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one.

Molecular Properties

Compound Name6-amino-2-pyridin-4-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
PubChem CID82271709
Molecular FormulaC11H9N5O
Molecular Weight227.23 g/mol
Exact Mass227.08
IUPAC Name6-amino-2-pyridin-4-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
SMILESNc1cnc2cc(-c3ccncc3)[nH]n2c1=O
InChIInChI=1S/C11H9N5O/c12-8-6-14-10-5-9(15-16(10)11(8)17)7-1-3-13-4-2-7/h1-6,15H,12H2
InChIKeySVEXGSDTMPAHDI-UHFFFAOYSA-N
XLogP0.67
TPSA89.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.23
LogP ≤ 50.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-amino-2-(3,5-dimethoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 82271704
6-(aminomethyl)-2-phenyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 115043650
5-methyl-2-pyridin-4-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 86164563
6-pyridin-4-yl-5H-imidazo[1,2-b]pyrazole
CID 121214916
5-[(4-fluorophenyl)methyl]-11-pyridin-4-yl-1,5,8,12-tetrazatricyclo[7.3.0.03,7]dodeca-3(7),8,10-triene-2,6-dione
CID 142565222
5-[(3,5-difluorophenyl)methyl]-2-pyridin-4-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 172670444
3-methyl-7-phenyl-6H-pyrazolo[5,1-c][1,2,4]triazin-4-one
CID 20578627
5-[(2,4-difluorophenyl)methyl]-2-pyridin-4-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 172673083
5-[1-(3-methoxyphenoxy)ethyl]-2-pyridin-4-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 172666274
6-(2-aminoethyl)-5-methyl-2-pyridin-3-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 82271828
5-[(2-oxopiperidin-1-yl)methyl]-2-pyridin-4-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 172656577
7-phenyl-6H-pyrazolo[5,1-c][1,2,4]triazin-4-one
CID 102478161

Frequently Asked Questions

What is the IUPAC name of 6-amino-2-pyridin-4-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The IUPAC name of 6-amino-2-pyridin-4-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one (CID 82271709) is 6-amino-2-pyridin-4-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one.
What is the SMILES notation for 6-amino-2-pyridin-4-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The canonical SMILES for 6-amino-2-pyridin-4-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one is Nc1cnc2cc(-c3ccncc3)[nH]n2c1=O.
What is the InChIKey of 6-amino-2-pyridin-4-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The InChIKey is SVEXGSDTMPAHDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N5O/c12-8-6-14-10-5-9(15-16(10)11(8)17)7-1-3-13-4-2-7/h1-6,15H,12H2.
What are the key properties of 6-amino-2-pyridin-4-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
6-amino-2-pyridin-4-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one has a molecular weight of 227.23 g/mol, XLogP of 0.67, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-2-pyridin-4-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one is sourced from PubChem (CID 82271709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).