6-ethyl-2,7-dimethyl-4H-pyrazolo[1,5-a]pyrimidin-5-one

C10H13N3O — CID 135412467

IUPAC6-ethyl-2,7-dimethyl-4H-pyrazolo[1,5-a]pyrimidin-5-one
SMILESCCc1c(C)n2nc(C)cc2[nH]c1=O
InChIInChI=1S/C10H13N3O/c1-4-8-7(3)13-9(11-10(8)14)5-6(2)12-13/h5H,4H2,1-3H3,(H,11,14)
InChIKeySSBOTAFCKSQJTL-UHFFFAOYSA-N
MW191.23 g/mol
LogP1.20
Rot. Bonds1

About 6-ethyl-2,7-dimethyl-4H-pyrazolo[1,5-a]pyrimidin-5-one

6-ethyl-2,7-dimethyl-4H-pyrazolo[1,5-a]pyrimidin-5-one (PubChem CID 135412467) has the molecular formula C10H13N3O and a molecular weight of 191.23 g/mol. Its IUPAC name is 6-ethyl-2,7-dimethyl-4H-pyrazolo[1,5-a]pyrimidin-5-one.

Molecular Properties

Compound Name6-ethyl-2,7-dimethyl-4H-pyrazolo[1,5-a]pyrimidin-5-one
PubChem CID135412467
Molecular FormulaC10H13N3O
Molecular Weight191.23 g/mol
Exact Mass191.11
IUPAC Name6-ethyl-2,7-dimethyl-4H-pyrazolo[1,5-a]pyrimidin-5-one
SMILESCCc1c(C)n2nc(C)cc2[nH]c1=O
InChIInChI=1S/C10H13N3O/c1-4-8-7(3)13-9(11-10(8)14)5-6(2)12-13/h5H,4H2,1-3H3,(H,11,14)
InChIKeySSBOTAFCKSQJTL-UHFFFAOYSA-N
XLogP1.20
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3,5-Dimethyl-1H-pyrazol-1-yl)-6-methylpyrimidin-4-ol
CID 135449532
2-(5-amino-3-methyl-1H-pyrazol-1-yl)-6-methyl-3,4-dihydropyrimidin-4-one
CID 135778888
2-(5-amino-3-methyl-1H-pyrazol-1-yl)-6-ethyl-3,4-dihydropyrimidin-4-one
CID 135876292
2-(5-amino-3-methyl-1H-pyrazol-1-yl)-6-propyl-3,4-dihydropyrimidin-4-one
CID 135876298
N-(1-(4,5-dimethyl-6-oxo-1,6-dihydropyrimidin-2-yl)-3-methyl-1H-pyrazol-5-yl)isobutyramide
CID 135551469
2-[5-(ethylamino)-3-methylpyrazol-1-yl]-4-(trifluoromethyl)-1H-pyrimidin-6-one
CID 162676141
N-(1-(4-ethyl-6-oxo-1,6-dihydropyrimidin-2-yl)-3-methyl-1H-pyrazol-5-yl)acetamide
CID 135753026
N-(3-methyl-1-(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)-1H-pyrazol-5-yl)isobutyramide
CID 135752890
N-[1-(4-ethyl-6-oxo-1,6-dihydro-2-pyrimidinyl)-3-methyl-5-pyrazolyl]cyclopropanecarboxamide
CID 135753036
2-(5-amino-3-methyl-1H-pyrazol-1-yl)-5-ethyl-6-methylpyrimidin-4(3H)-one
CID 135876299
N-(2,5-dimethylpyrazol-3-yl)acetamide
CID 574162
N-(1-(tert-Butyl)-3-methyl-1H-pyrazol-5-yl)acetamide
CID 6621900

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-2,7-dimethyl-4H-pyrazolo[1,5-a]pyrimidin-5-one?
The IUPAC name of 6-ethyl-2,7-dimethyl-4H-pyrazolo[1,5-a]pyrimidin-5-one (CID 135412467) is 6-ethyl-2,7-dimethyl-4H-pyrazolo[1,5-a]pyrimidin-5-one.
What is the SMILES notation for 6-ethyl-2,7-dimethyl-4H-pyrazolo[1,5-a]pyrimidin-5-one?
The canonical SMILES for 6-ethyl-2,7-dimethyl-4H-pyrazolo[1,5-a]pyrimidin-5-one is CCc1c(C)n2nc(C)cc2[nH]c1=O.
What is the InChIKey of 6-ethyl-2,7-dimethyl-4H-pyrazolo[1,5-a]pyrimidin-5-one?
The InChIKey is SSBOTAFCKSQJTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O/c1-4-8-7(3)13-9(11-10(8)14)5-6(2)12-13/h5H,4H2,1-3H3,(H,11,14).
What are the key properties of 6-ethyl-2,7-dimethyl-4H-pyrazolo[1,5-a]pyrimidin-5-one?
6-ethyl-2,7-dimethyl-4H-pyrazolo[1,5-a]pyrimidin-5-one has a molecular weight of 191.23 g/mol, XLogP of 1.20, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-2,7-dimethyl-4H-pyrazolo[1,5-a]pyrimidin-5-one is sourced from PubChem (CID 135412467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).