5-methyl-N-(2-oxopiperidin-3-yl)pyrazolo[1,5-a]pyrimidine-7-carboxamide

C13H15N5O2 — CID 110090685

IUPAC5-methyl-N-(2-oxopiperidin-3-yl)pyrazolo[1,5-a]pyrimidine-7-carboxamide
SMILESCc1cc(C(=O)NC2CCCNC2=O)n2nccc2n1
InChIInChI=1S/C13H15N5O2/c1-8-7-10(18-11(16-8)4-6-15-18)13(20)17-9-3-2-5-14-12(9)19/h4,6-7,9H,2-3,5H2,1H3,(H,14,19)(H,17,20)
InChIKeyGNDLNLVMJUIWQG-UHFFFAOYSA-N
MW273.30 g/mol
LogP0.05
Rot. Bonds2

About 5-methyl-N-(2-oxopiperidin-3-yl)pyrazolo[1,5-a]pyrimidine-7-carboxamide

5-methyl-N-(2-oxopiperidin-3-yl)pyrazolo[1,5-a]pyrimidine-7-carboxamide (PubChem CID 110090685) has the molecular formula C13H15N5O2 and a molecular weight of 273.30 g/mol. Its IUPAC name is 5-methyl-N-(2-oxopiperidin-3-yl)pyrazolo[1,5-a]pyrimidine-7-carboxamide.

Molecular Properties

Compound Name5-methyl-N-(2-oxopiperidin-3-yl)pyrazolo[1,5-a]pyrimidine-7-carboxamide
PubChem CID110090685
Molecular FormulaC13H15N5O2
Molecular Weight273.30 g/mol
Exact Mass273.12
IUPAC Name5-methyl-N-(2-oxopiperidin-3-yl)pyrazolo[1,5-a]pyrimidine-7-carboxamide
SMILESCc1cc(C(=O)NC2CCCNC2=O)n2nccc2n1
InChIInChI=1S/C13H15N5O2/c1-8-7-10(18-11(16-8)4-6-15-18)13(20)17-9-3-2-5-14-12(9)19/h4,6-7,9H,2-3,5H2,1H3,(H,14,19)(H,17,20)
InChIKeyGNDLNLVMJUIWQG-UHFFFAOYSA-N
XLogP0.05
TPSA88.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.30
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(2-oxopiperidin-3-yl)pyrazolo[1,5-a]pyrimidine-7-carboxamide?
The IUPAC name of 5-methyl-N-(2-oxopiperidin-3-yl)pyrazolo[1,5-a]pyrimidine-7-carboxamide (CID 110090685) is 5-methyl-N-(2-oxopiperidin-3-yl)pyrazolo[1,5-a]pyrimidine-7-carboxamide.
What is the SMILES notation for 5-methyl-N-(2-oxopiperidin-3-yl)pyrazolo[1,5-a]pyrimidine-7-carboxamide?
The canonical SMILES for 5-methyl-N-(2-oxopiperidin-3-yl)pyrazolo[1,5-a]pyrimidine-7-carboxamide is Cc1cc(C(=O)NC2CCCNC2=O)n2nccc2n1.
What is the InChIKey of 5-methyl-N-(2-oxopiperidin-3-yl)pyrazolo[1,5-a]pyrimidine-7-carboxamide?
The InChIKey is GNDLNLVMJUIWQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N5O2/c1-8-7-10(18-11(16-8)4-6-15-18)13(20)17-9-3-2-5-14-12(9)19/h4,6-7,9H,2-3,5H2,1H3,(H,14,19)(H,17,20).
What are the key properties of 5-methyl-N-(2-oxopiperidin-3-yl)pyrazolo[1,5-a]pyrimidine-7-carboxamide?
5-methyl-N-(2-oxopiperidin-3-yl)pyrazolo[1,5-a]pyrimidine-7-carboxamide has a molecular weight of 273.30 g/mol, XLogP of 0.05, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(2-oxopiperidin-3-yl)pyrazolo[1,5-a]pyrimidine-7-carboxamide is sourced from PubChem (CID 110090685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).