5-piperidin-3-yl-3-pyridin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine

C16H18N6 — CID 53322026

IUPAC5-piperidin-3-yl-3-pyridin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine
SMILESNc1cc(C2CCCNC2)nc2c(-c3cccnc3)cnn12
InChIInChI=1S/C16H18N6/c17-15-7-14(12-4-2-6-19-9-12)21-16-13(10-20-22(15)16)11-3-1-5-18-8-11/h1,3,5,7-8,10,12,19H,2,4,6,9,17H2
InChIKeyKKFDWLKKEGHTIZ-UHFFFAOYSA-N
MW294.36 g/mol
LogP1.84
Rot. Bonds2

About 5-piperidin-3-yl-3-pyridin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine

5-piperidin-3-yl-3-pyridin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 53322026) has the molecular formula C16H18N6 and a molecular weight of 294.36 g/mol. Its IUPAC name is 5-piperidin-3-yl-3-pyridin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound Name5-piperidin-3-yl-3-pyridin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID53322026
Molecular FormulaC16H18N6
Molecular Weight294.36 g/mol
Exact Mass294.16
IUPAC Name5-piperidin-3-yl-3-pyridin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine
SMILESNc1cc(C2CCCNC2)nc2c(-c3cccnc3)cnn12
InChIInChI=1S/C16H18N6/c17-15-7-14(12-4-2-6-19-9-12)21-16-13(10-20-22(15)16)11-3-1-5-18-8-11/h1,3,5,7-8,10,12,19H,2,4,6,9,17H2
InChIKeyKKFDWLKKEGHTIZ-UHFFFAOYSA-N
XLogP1.84
TPSA81.13 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.36
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-piperidin-3-yl-3-pyridin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of 5-piperidin-3-yl-3-pyridin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine (CID 53322026) is 5-piperidin-3-yl-3-pyridin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for 5-piperidin-3-yl-3-pyridin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for 5-piperidin-3-yl-3-pyridin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine is Nc1cc(C2CCCNC2)nc2c(-c3cccnc3)cnn12.
What is the InChIKey of 5-piperidin-3-yl-3-pyridin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is KKFDWLKKEGHTIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N6/c17-15-7-14(12-4-2-6-19-9-12)21-16-13(10-20-22(15)16)11-3-1-5-18-8-11/h1,3,5,7-8,10,12,19H,2,4,6,9,17H2.
What are the key properties of 5-piperidin-3-yl-3-pyridin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine?
5-piperidin-3-yl-3-pyridin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 294.36 g/mol, XLogP of 1.84, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-piperidin-3-yl-3-pyridin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 53322026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).