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

C12H15N3O — CID 104621505

IUPAC5-cyclopentyl-3-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
SMILESCc1c[nH]n2c(=O)cc(C3CCCC3)nc12
InChIInChI=1S/C12H15N3O/c1-8-7-13-15-11(16)6-10(14-12(8)15)9-4-2-3-5-9/h6-7,9,13H,2-5H2,1H3
InChIKeyMQVZHDLKLIQHCP-UHFFFAOYSA-N
MW217.27 g/mol
LogP1.99
Rot. Bonds1

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

5-cyclopentyl-3-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one (PubChem CID 104621505) has the molecular formula C12H15N3O and a molecular weight of 217.27 g/mol. Its IUPAC name is 5-cyclopentyl-3-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one.

Molecular Properties

Compound Name5-cyclopentyl-3-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
PubChem CID104621505
Molecular FormulaC12H15N3O
Molecular Weight217.27 g/mol
Exact Mass217.12
IUPAC Name5-cyclopentyl-3-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
SMILESCc1c[nH]n2c(=O)cc(C3CCCC3)nc12
InChIInChI=1S/C12H15N3O/c1-8-7-13-15-11(16)6-10(14-12(8)15)9-4-2-3-5-9/h6-7,9,13H,2-5H2,1H3
InChIKeyMQVZHDLKLIQHCP-UHFFFAOYSA-N
XLogP1.99
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-cyclopentyl-3-ethyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 113433939
5-cyclobutyl-3-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 22308884
5-cyclopropyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylic acid
CID 83678981
3-chloro-5-piperidin-4-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 115054586
5-piperidin-3-yl-3-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 115054548
3-tert-butyl-5-piperidin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 115054544
5-(azepan-4-yl)-3-chloro-2-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 45168309
5-(methoxymethyl)-3-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 104621503
5-(4-ethylsulfanylphenyl)-3-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 164541055
3-methyl-5-(2-methylsulfanylpyrimidin-4-yl)-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 169291385
4-(7-oxo-3-pyridin-3-yl-1H-pyrazolo[1,5-a]pyrimidin-5-yl)piperidine-1-carboxylic acid
CID 121319937
3-bromo-6-cyclopentyl-2-(2H-triazol-4-yl)pyrimidin-4-one
CID 142347367

Frequently Asked Questions

What is the IUPAC name of 5-cyclopentyl-3-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The IUPAC name of 5-cyclopentyl-3-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one (CID 104621505) is 5-cyclopentyl-3-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one.
What is the SMILES notation for 5-cyclopentyl-3-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The canonical SMILES for 5-cyclopentyl-3-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one is Cc1c[nH]n2c(=O)cc(C3CCCC3)nc12.
What is the InChIKey of 5-cyclopentyl-3-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The InChIKey is MQVZHDLKLIQHCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O/c1-8-7-13-15-11(16)6-10(14-12(8)15)9-4-2-3-5-9/h6-7,9,13H,2-5H2,1H3.
What are the key properties of 5-cyclopentyl-3-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
5-cyclopentyl-3-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one has a molecular weight of 217.27 g/mol, XLogP of 1.99, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopentyl-3-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one is sourced from PubChem (CID 104621505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).