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

C10H13N3O — CID 3241549

IUPAC2-methyl-5-propyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
SMILESCCCc1cc(=O)n2[nH]c(C)cc2n1
InChIInChI=1S/C10H13N3O/c1-3-4-8-6-10(14)13-9(11-8)5-7(2)12-13/h5-6,12H,3-4H2,1-2H3
InChIKeyGRVLFRMEWMAQNC-UHFFFAOYSA-N
MW191.23 g/mol
LogP1.28
Rot. Bonds2

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

2-methyl-5-propyl-1H-pyrazolo[1,5-a]pyrimidin-7-one (PubChem CID 3241549) has the molecular formula C10H13N3O and a molecular weight of 191.23 g/mol. Its IUPAC name is 2-methyl-5-propyl-1H-pyrazolo[1,5-a]pyrimidin-7-one.

Molecular Properties

Compound Name2-methyl-5-propyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
PubChem CID3241549
Molecular FormulaC10H13N3O
Molecular Weight191.23 g/mol
Exact Mass191.11
IUPAC Name2-methyl-5-propyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
SMILESCCCc1cc(=O)n2[nH]c(C)cc2n1
InChIInChI=1S/C10H13N3O/c1-3-4-8-6-10(14)13-9(11-8)5-7(2)12-13/h5-6,12H,3-4H2,1-2H3
InChIKeyGRVLFRMEWMAQNC-UHFFFAOYSA-N
XLogP1.28
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-propyl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The IUPAC name of 2-methyl-5-propyl-1H-pyrazolo[1,5-a]pyrimidin-7-one (CID 3241549) is 2-methyl-5-propyl-1H-pyrazolo[1,5-a]pyrimidin-7-one.
What is the SMILES notation for 2-methyl-5-propyl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The canonical SMILES for 2-methyl-5-propyl-1H-pyrazolo[1,5-a]pyrimidin-7-one is CCCc1cc(=O)n2[nH]c(C)cc2n1.
What is the InChIKey of 2-methyl-5-propyl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The InChIKey is GRVLFRMEWMAQNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O/c1-3-4-8-6-10(14)13-9(11-8)5-7(2)12-13/h5-6,12H,3-4H2,1-2H3.
What are the key properties of 2-methyl-5-propyl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
2-methyl-5-propyl-1H-pyrazolo[1,5-a]pyrimidin-7-one has a molecular weight of 191.23 g/mol, XLogP of 1.28, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-propyl-1H-pyrazolo[1,5-a]pyrimidin-7-one is sourced from PubChem (CID 3241549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).