5-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]-3-ethyl-2-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one

C17H22N4O2 — CID 110216177

IUPAC5-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]-3-ethyl-2-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
SMILESCCc1c(C)[nH]n2c(=O)cc(C3CCN(C(=O)C4CC4)C3)nc12
InChIInChI=1S/C17H22N4O2/c1-3-13-10(2)19-21-15(22)8-14(18-16(13)21)12-6-7-20(9-12)17(23)11-4-5-11/h8,11-12,19H,3-7,9H2,1-2H3
InChIKeyJZXSIORVHSMVGR-UHFFFAOYSA-N
MW314.39 g/mol
LogP1.62
Rot. Bonds3

About 5-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]-3-ethyl-2-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one

5-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]-3-ethyl-2-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one (PubChem CID 110216177) has the molecular formula C17H22N4O2 and a molecular weight of 314.39 g/mol. Its IUPAC name is 5-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]-3-ethyl-2-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one.

Molecular Properties

Compound Name5-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]-3-ethyl-2-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
PubChem CID110216177
Molecular FormulaC17H22N4O2
Molecular Weight314.39 g/mol
Exact Mass314.17
IUPAC Name5-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]-3-ethyl-2-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
SMILESCCc1c(C)[nH]n2c(=O)cc(C3CCN(C(=O)C4CC4)C3)nc12
InChIInChI=1S/C17H22N4O2/c1-3-13-10(2)19-21-15(22)8-14(18-16(13)21)12-6-7-20(9-12)17(23)11-4-5-11/h8,11-12,19H,3-7,9H2,1-2H3
InChIKeyJZXSIORVHSMVGR-UHFFFAOYSA-N
XLogP1.62
TPSA70.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.39
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]-3-ethyl-2-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]-3-ethyl-2-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The IUPAC name of 5-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]-3-ethyl-2-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one (CID 110216177) is 5-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]-3-ethyl-2-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one.
What is the SMILES notation for 5-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]-3-ethyl-2-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The canonical SMILES for 5-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]-3-ethyl-2-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one is CCc1c(C)[nH]n2c(=O)cc(C3CCN(C(=O)C4CC4)C3)nc12.
What is the InChIKey of 5-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]-3-ethyl-2-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The InChIKey is JZXSIORVHSMVGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4O2/c1-3-13-10(2)19-21-15(22)8-14(18-16(13)21)12-6-7-20(9-12)17(23)11-4-5-11/h8,11-12,19H,3-7,9H2,1-2H3.
What are the key properties of 5-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]-3-ethyl-2-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
5-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]-3-ethyl-2-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one has a molecular weight of 314.39 g/mol, XLogP of 1.62, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]-3-ethyl-2-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one is sourced from PubChem (CID 110216177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).