2,5-diethyl-3-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one

C11H15N3O — CID 19975843

IUPAC2,5-diethyl-3-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
SMILESCCc1cc(=O)n2[nH]c(CC)c(C)c2n1
InChIInChI=1S/C11H15N3O/c1-4-8-6-10(15)14-11(12-8)7(3)9(5-2)13-14/h6,13H,4-5H2,1-3H3
InChIKeyFNGAHXDSIIEBQL-UHFFFAOYSA-N
MW205.26 g/mol
LogP1.46
Rot. Bonds2

About 2,5-diethyl-3-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one

2,5-diethyl-3-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one (PubChem CID 19975843) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is 2,5-diethyl-3-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one.

Molecular Properties

Compound Name2,5-diethyl-3-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
PubChem CID19975843
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Name2,5-diethyl-3-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
SMILESCCc1cc(=O)n2[nH]c(CC)c(C)c2n1
InChIInChI=1S/C11H15N3O/c1-4-8-6-10(15)14-11(12-8)7(3)9(5-2)13-14/h6,13H,4-5H2,1-3H3
InChIKeyFNGAHXDSIIEBQL-UHFFFAOYSA-N
XLogP1.46
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,5-diethyl-3-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The IUPAC name of 2,5-diethyl-3-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one (CID 19975843) is 2,5-diethyl-3-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one.
What is the SMILES notation for 2,5-diethyl-3-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The canonical SMILES for 2,5-diethyl-3-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one is CCc1cc(=O)n2[nH]c(CC)c(C)c2n1.
What is the InChIKey of 2,5-diethyl-3-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The InChIKey is FNGAHXDSIIEBQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c1-4-8-6-10(15)14-11(12-8)7(3)9(5-2)13-14/h6,13H,4-5H2,1-3H3.
What are the key properties of 2,5-diethyl-3-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
2,5-diethyl-3-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one has a molecular weight of 205.26 g/mol, XLogP of 1.46, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-diethyl-3-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one is sourced from PubChem (CID 19975843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).