5-piperidin-3-yloxy-3-propan-2-ylpyrazolo[1,5-a]pyrimidine

C14H20N4O — CID 175980125

IUPAC5-piperidin-3-yloxy-3-propan-2-ylpyrazolo[1,5-a]pyrimidine
SMILESCC(C)c1cnn2ccc(OC3CCCNC3)nc12
InChIInChI=1S/C14H20N4O/c1-10(2)12-9-16-18-7-5-13(17-14(12)18)19-11-4-3-6-15-8-11/h5,7,9-11,15H,3-4,6,8H2,1-2H3
InChIKeyKSANBYNMINWMNF-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.98
Rot. Bonds3

About 5-piperidin-3-yloxy-3-propan-2-ylpyrazolo[1,5-a]pyrimidine

5-piperidin-3-yloxy-3-propan-2-ylpyrazolo[1,5-a]pyrimidine (PubChem CID 175980125) has the molecular formula C14H20N4O and a molecular weight of 260.34 g/mol. Its IUPAC name is 5-piperidin-3-yloxy-3-propan-2-ylpyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name5-piperidin-3-yloxy-3-propan-2-ylpyrazolo[1,5-a]pyrimidine
PubChem CID175980125
Molecular FormulaC14H20N4O
Molecular Weight260.34 g/mol
Exact Mass260.16
IUPAC Name5-piperidin-3-yloxy-3-propan-2-ylpyrazolo[1,5-a]pyrimidine
SMILESCC(C)c1cnn2ccc(OC3CCCNC3)nc12
InChIInChI=1S/C14H20N4O/c1-10(2)12-9-16-18-7-5-13(17-14(12)18)19-11-4-3-6-15-8-11/h5,7,9-11,15H,3-4,6,8H2,1-2H3
InChIKeyKSANBYNMINWMNF-UHFFFAOYSA-N
XLogP1.98
TPSA51.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-piperidin-3-yloxy-3-propan-2-ylpyrazolo[1,5-a]pyrimidine?
The IUPAC name of 5-piperidin-3-yloxy-3-propan-2-ylpyrazolo[1,5-a]pyrimidine (CID 175980125) is 5-piperidin-3-yloxy-3-propan-2-ylpyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 5-piperidin-3-yloxy-3-propan-2-ylpyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 5-piperidin-3-yloxy-3-propan-2-ylpyrazolo[1,5-a]pyrimidine is CC(C)c1cnn2ccc(OC3CCCNC3)nc12.
What is the InChIKey of 5-piperidin-3-yloxy-3-propan-2-ylpyrazolo[1,5-a]pyrimidine?
The InChIKey is KSANBYNMINWMNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O/c1-10(2)12-9-16-18-7-5-13(17-14(12)18)19-11-4-3-6-15-8-11/h5,7,9-11,15H,3-4,6,8H2,1-2H3.
What are the key properties of 5-piperidin-3-yloxy-3-propan-2-ylpyrazolo[1,5-a]pyrimidine?
5-piperidin-3-yloxy-3-propan-2-ylpyrazolo[1,5-a]pyrimidine has a molecular weight of 260.34 g/mol, XLogP of 1.98, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-piperidin-3-yloxy-3-propan-2-ylpyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 175980125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).