5-(methoxymethyl)-2-(3-methoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one

C15H15N3O3 — CID 2819066

IUPAC5-(methoxymethyl)-2-(3-methoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one
SMILESCOCc1cc(=O)n2[nH]c(-c3cccc(OC)c3)cc2n1
InChIInChI=1S/C15H15N3O3/c1-20-9-11-7-15(19)18-14(16-11)8-13(17-18)10-4-3-5-12(6-10)21-2/h3-8,17H,9H2,1-2H3
InChIKeyRJVISKWBLRHVBF-UHFFFAOYSA-N
MW285.30 g/mol
LogP1.84
Rot. Bonds4

About 5-(methoxymethyl)-2-(3-methoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one

5-(methoxymethyl)-2-(3-methoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one (PubChem CID 2819066) has the molecular formula C15H15N3O3 and a molecular weight of 285.30 g/mol. Its IUPAC name is 5-(methoxymethyl)-2-(3-methoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one.

Molecular Properties

Compound Name5-(methoxymethyl)-2-(3-methoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one
PubChem CID2819066
Molecular FormulaC15H15N3O3
Molecular Weight285.30 g/mol
Exact Mass285.11
IUPAC Name5-(methoxymethyl)-2-(3-methoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one
SMILESCOCc1cc(=O)n2[nH]c(-c3cccc(OC)c3)cc2n1
InChIInChI=1S/C15H15N3O3/c1-20-9-11-7-15(19)18-14(16-11)8-13(17-18)10-4-3-5-12(6-10)21-2/h3-8,17H,9H2,1-2H3
InChIKeyRJVISKWBLRHVBF-UHFFFAOYSA-N
XLogP1.84
TPSA68.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.30
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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CID 1266350
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CID 1851458
CID 1851458
CID 3156107
CID 3156107
CID 977455
CID 977455
CID 3157234
CID 3157234
CID 867736
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CID 2810122
CID 2810122

Frequently Asked Questions

What is the IUPAC name of 5-(methoxymethyl)-2-(3-methoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The IUPAC name of 5-(methoxymethyl)-2-(3-methoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one (CID 2819066) is 5-(methoxymethyl)-2-(3-methoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one.
What is the SMILES notation for 5-(methoxymethyl)-2-(3-methoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The canonical SMILES for 5-(methoxymethyl)-2-(3-methoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one is COCc1cc(=O)n2[nH]c(-c3cccc(OC)c3)cc2n1.
What is the InChIKey of 5-(methoxymethyl)-2-(3-methoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The InChIKey is RJVISKWBLRHVBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O3/c1-20-9-11-7-15(19)18-14(16-11)8-13(17-18)10-4-3-5-12(6-10)21-2/h3-8,17H,9H2,1-2H3.
What are the key properties of 5-(methoxymethyl)-2-(3-methoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one?
5-(methoxymethyl)-2-(3-methoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one has a molecular weight of 285.30 g/mol, XLogP of 1.84, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methoxymethyl)-2-(3-methoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one is sourced from PubChem (CID 2819066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).