4-(4-hydroxypiperidin-1-yl)-N-pyrazolo[1,5-a]pyrimidin-7-ylbenzamide

C18H19N5O2 — CID 71984913

IUPAC4-(4-hydroxypiperidin-1-yl)-N-pyrazolo[1,5-a]pyrimidin-7-ylbenzamide
SMILESO=C(Nc1ccnc2ccnn12)c1ccc(N2CCC(O)CC2)cc1
InChIInChI=1S/C18H19N5O2/c24-15-7-11-22(12-8-15)14-3-1-13(2-4-14)18(25)21-17-5-9-19-16-6-10-20-23(16)17/h1-6,9-10,15,24H,7-8,11-12H2,(H,21,25)
InChIKeyUQTIYTCYHZJZKS-UHFFFAOYSA-N
MW337.38 g/mol
LogP1.94
Rot. Bonds3

About 4-(4-hydroxypiperidin-1-yl)-N-pyrazolo[1,5-a]pyrimidin-7-ylbenzamide

4-(4-hydroxypiperidin-1-yl)-N-pyrazolo[1,5-a]pyrimidin-7-ylbenzamide (PubChem CID 71984913) has the molecular formula C18H19N5O2 and a molecular weight of 337.38 g/mol. Its IUPAC name is 4-(4-hydroxypiperidin-1-yl)-N-pyrazolo[1,5-a]pyrimidin-7-ylbenzamide.

Molecular Properties

Compound Name4-(4-hydroxypiperidin-1-yl)-N-pyrazolo[1,5-a]pyrimidin-7-ylbenzamide
PubChem CID71984913
Molecular FormulaC18H19N5O2
Molecular Weight337.38 g/mol
Exact Mass337.15
IUPAC Name4-(4-hydroxypiperidin-1-yl)-N-pyrazolo[1,5-a]pyrimidin-7-ylbenzamide
SMILESO=C(Nc1ccnc2ccnn12)c1ccc(N2CCC(O)CC2)cc1
InChIInChI=1S/C18H19N5O2/c24-15-7-11-22(12-8-15)14-3-1-13(2-4-14)18(25)21-17-5-9-19-16-6-10-20-23(16)17/h1-6,9-10,15,24H,7-8,11-12H2,(H,21,25)
InChIKeyUQTIYTCYHZJZKS-UHFFFAOYSA-N
XLogP1.94
TPSA82.76 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(4-hydroxypiperidin-1-yl)-N-pyrazolo[1,5-a]pyrimidin-7-ylbenzamide?
The IUPAC name of 4-(4-hydroxypiperidin-1-yl)-N-pyrazolo[1,5-a]pyrimidin-7-ylbenzamide (CID 71984913) is 4-(4-hydroxypiperidin-1-yl)-N-pyrazolo[1,5-a]pyrimidin-7-ylbenzamide.
What is the SMILES notation for 4-(4-hydroxypiperidin-1-yl)-N-pyrazolo[1,5-a]pyrimidin-7-ylbenzamide?
The canonical SMILES for 4-(4-hydroxypiperidin-1-yl)-N-pyrazolo[1,5-a]pyrimidin-7-ylbenzamide is O=C(Nc1ccnc2ccnn12)c1ccc(N2CCC(O)CC2)cc1.
What is the InChIKey of 4-(4-hydroxypiperidin-1-yl)-N-pyrazolo[1,5-a]pyrimidin-7-ylbenzamide?
The InChIKey is UQTIYTCYHZJZKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N5O2/c24-15-7-11-22(12-8-15)14-3-1-13(2-4-14)18(25)21-17-5-9-19-16-6-10-20-23(16)17/h1-6,9-10,15,24H,7-8,11-12H2,(H,21,25).
What are the key properties of 4-(4-hydroxypiperidin-1-yl)-N-pyrazolo[1,5-a]pyrimidin-7-ylbenzamide?
4-(4-hydroxypiperidin-1-yl)-N-pyrazolo[1,5-a]pyrimidin-7-ylbenzamide has a molecular weight of 337.38 g/mol, XLogP of 1.94, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-hydroxypiperidin-1-yl)-N-pyrazolo[1,5-a]pyrimidin-7-ylbenzamide is sourced from PubChem (CID 71984913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).