3-(morpholin-4-ylmethyl)-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidin-5-one

C16H23N5O2 — CID 137018357

IUPAC3-(morpholin-4-ylmethyl)-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidin-5-one
SMILESO=c1cc(C2CCNCC2)n2ncc(CN3CCOCC3)c2[nH]1
InChIInChI=1S/C16H23N5O2/c22-15-9-14(12-1-3-17-4-2-12)21-16(19-15)13(10-18-21)11-20-5-7-23-8-6-20/h9-10,12,17H,1-8,11H2,(H,19,22)
InChIKeyCYBORROADRJVAW-UHFFFAOYSA-N
MW317.39 g/mol
LogP0.32
Rot. Bonds3

About 3-(morpholin-4-ylmethyl)-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidin-5-one

3-(morpholin-4-ylmethyl)-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidin-5-one (PubChem CID 137018357) has the molecular formula C16H23N5O2 and a molecular weight of 317.39 g/mol. Its IUPAC name is 3-(morpholin-4-ylmethyl)-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidin-5-one.

Molecular Properties

Compound Name3-(morpholin-4-ylmethyl)-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidin-5-one
PubChem CID137018357
Molecular FormulaC16H23N5O2
Molecular Weight317.39 g/mol
Exact Mass317.19
IUPAC Name3-(morpholin-4-ylmethyl)-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidin-5-one
SMILESO=c1cc(C2CCNCC2)n2ncc(CN3CCOCC3)c2[nH]1
InChIInChI=1S/C16H23N5O2/c22-15-9-14(12-1-3-17-4-2-12)21-16(19-15)13(10-18-21)11-20-5-7-23-8-6-20/h9-10,12,17H,1-8,11H2,(H,19,22)
InChIKeyCYBORROADRJVAW-UHFFFAOYSA-N
XLogP0.32
TPSA74.66 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 50.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 3-(morpholin-4-ylmethyl)-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidin-5-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(morpholin-4-ylmethyl)-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidin-5-one?
The IUPAC name of 3-(morpholin-4-ylmethyl)-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidin-5-one (CID 137018357) is 3-(morpholin-4-ylmethyl)-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidin-5-one.
What is the SMILES notation for 3-(morpholin-4-ylmethyl)-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidin-5-one?
The canonical SMILES for 3-(morpholin-4-ylmethyl)-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidin-5-one is O=c1cc(C2CCNCC2)n2ncc(CN3CCOCC3)c2[nH]1.
What is the InChIKey of 3-(morpholin-4-ylmethyl)-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidin-5-one?
The InChIKey is CYBORROADRJVAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N5O2/c22-15-9-14(12-1-3-17-4-2-12)21-16(19-15)13(10-18-21)11-20-5-7-23-8-6-20/h9-10,12,17H,1-8,11H2,(H,19,22).
What are the key properties of 3-(morpholin-4-ylmethyl)-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidin-5-one?
3-(morpholin-4-ylmethyl)-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidin-5-one has a molecular weight of 317.39 g/mol, XLogP of 0.32, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(morpholin-4-ylmethyl)-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidin-5-one is sourced from PubChem (CID 137018357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).