7-piperidin-3-yl-2-thiophen-2-ylpyrazolo[1,5-a]pyrimidine

C15H16N4S — CID 24865424

IUPAC7-piperidin-3-yl-2-thiophen-2-ylpyrazolo[1,5-a]pyrimidine
SMILESc1csc(-c2cc3nccc(C4CCCNC4)n3n2)c1
InChIInChI=1S/C15H16N4S/c1-3-11(10-16-6-1)13-5-7-17-15-9-12(18-19(13)15)14-4-2-8-20-14/h2,4-5,7-9,11,16H,1,3,6,10H2
InChIKeyVSOISRFVSXEYAB-UHFFFAOYSA-N
MW284.39 g/mol
LogP2.92
Rot. Bonds2

About 7-piperidin-3-yl-2-thiophen-2-ylpyrazolo[1,5-a]pyrimidine

7-piperidin-3-yl-2-thiophen-2-ylpyrazolo[1,5-a]pyrimidine (PubChem CID 24865424) has the molecular formula C15H16N4S and a molecular weight of 284.39 g/mol. Its IUPAC name is 7-piperidin-3-yl-2-thiophen-2-ylpyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name7-piperidin-3-yl-2-thiophen-2-ylpyrazolo[1,5-a]pyrimidine
PubChem CID24865424
Molecular FormulaC15H16N4S
Molecular Weight284.39 g/mol
Exact Mass284.11
IUPAC Name7-piperidin-3-yl-2-thiophen-2-ylpyrazolo[1,5-a]pyrimidine
SMILESc1csc(-c2cc3nccc(C4CCCNC4)n3n2)c1
InChIInChI=1S/C15H16N4S/c1-3-11(10-16-6-1)13-5-7-17-15-9-12(18-19(13)15)14-4-2-8-20-14/h2,4-5,7-9,11,16H,1,3,6,10H2
InChIKeyVSOISRFVSXEYAB-UHFFFAOYSA-N
XLogP2.92
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.39
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[3-(Thiophen-3-yl)pyrazolo[1,5-a]pyrimidin-6-yl]pyridine
CID 5329467
6-Cyclohexyl-3-(thiophen-3-yl)pyrazolo[1,5-a]pyrimidine
CID 5329472
N-(2-pyridin-2-ylethyl)thieno[2,3-d]pyrimidin-4-amine
CID 2509600
7-(Thiophen-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine
CID 900945
2-(4-Aminopiperidin-1-Yl)-N-(5-Cyclopropyl-1h-Pyrazol-3-Yl)thieno[3,2-D]pyrimidin-4-Amine
CID 91809512
4-(5-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-2-amine
CID 137661231
5-(2-amino-4-pyridinyl)-2-methyl-N-(thiophen-2-ylmethyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine
CID 166629551
5-(2-amino-4-pyridinyl)-2-methyl-N-(thiophen-3-ylmethyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine
CID 166629640
3-((Pyridin-3-ylmethyl)thio)-6-(thiophen-2-yl)-[1,2,4]triazolo[4,3-b]pyridazine
CID 16194785
4-[4-[(3-Methyl-2-thienyl)-phenyl-methyl]piperazin-1-yl]-1-phenyl-pyrazolo[3,4-d]pyrimidine
CID 3011486
N-cyclopropyl-4-(6-(thiophen-2-yl)pyrazolo[1,5-b]pyridazin-3-yl)pyrimidin-2-amine
CID 10286648
3-bromo-N-(pyridin-3-ylmethyl)-5-(thiophen-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 10475216

Frequently Asked Questions

What is the IUPAC name of 7-piperidin-3-yl-2-thiophen-2-ylpyrazolo[1,5-a]pyrimidine?
The IUPAC name of 7-piperidin-3-yl-2-thiophen-2-ylpyrazolo[1,5-a]pyrimidine (CID 24865424) is 7-piperidin-3-yl-2-thiophen-2-ylpyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 7-piperidin-3-yl-2-thiophen-2-ylpyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 7-piperidin-3-yl-2-thiophen-2-ylpyrazolo[1,5-a]pyrimidine is c1csc(-c2cc3nccc(C4CCCNC4)n3n2)c1.
What is the InChIKey of 7-piperidin-3-yl-2-thiophen-2-ylpyrazolo[1,5-a]pyrimidine?
The InChIKey is VSOISRFVSXEYAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4S/c1-3-11(10-16-6-1)13-5-7-17-15-9-12(18-19(13)15)14-4-2-8-20-14/h2,4-5,7-9,11,16H,1,3,6,10H2.
What are the key properties of 7-piperidin-3-yl-2-thiophen-2-ylpyrazolo[1,5-a]pyrimidine?
7-piperidin-3-yl-2-thiophen-2-ylpyrazolo[1,5-a]pyrimidine has a molecular weight of 284.39 g/mol, XLogP of 2.92, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-piperidin-3-yl-2-thiophen-2-ylpyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 24865424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).