5-oxo-N-(oxolan-3-yl)-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidine-3-carboxamide

C16H21N5O3 — CID 137018277

IUPAC5-oxo-N-(oxolan-3-yl)-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESO=C(NC1CCOC1)c1cnn2c(C3CCNCC3)cc(=O)[nH]c12
InChIInChI=1S/C16H21N5O3/c22-14-7-13(10-1-4-17-5-2-10)21-15(20-14)12(8-18-21)16(23)19-11-3-6-24-9-11/h7-8,10-11,17H,1-6,9H2,(H,19,23)(H,20,22)
InChIKeyQHLDZELPDGJNGJ-UHFFFAOYSA-N
MW331.38 g/mol
LogP0.01
Rot. Bonds3

About 5-oxo-N-(oxolan-3-yl)-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidine-3-carboxamide

5-oxo-N-(oxolan-3-yl)-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 137018277) has the molecular formula C16H21N5O3 and a molecular weight of 331.38 g/mol. Its IUPAC name is 5-oxo-N-(oxolan-3-yl)-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name5-oxo-N-(oxolan-3-yl)-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID137018277
Molecular FormulaC16H21N5O3
Molecular Weight331.38 g/mol
Exact Mass331.16
IUPAC Name5-oxo-N-(oxolan-3-yl)-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESO=C(NC1CCOC1)c1cnn2c(C3CCNCC3)cc(=O)[nH]c12
InChIInChI=1S/C16H21N5O3/c22-14-7-13(10-1-4-17-5-2-10)21-15(20-14)12(8-18-21)16(23)19-11-3-6-24-9-11/h7-8,10-11,17H,1-6,9H2,(H,19,23)(H,20,22)
InChIKeyQHLDZELPDGJNGJ-UHFFFAOYSA-N
XLogP0.01
TPSA100.52 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.38
LogP ≤ 50.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 5-oxo-N-(oxolan-3-yl)-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidine-3-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

US10118930, Example 452
CID 137018609
US10118930, Example 101
CID 137018280
US10118930, Example 352
CID 137018395
US10118930, Example 354
CID 137018397
US10118930, Example 353
CID 137018542
US10118930, Example 355
CID 137018549
US10118930, Example 103
CID 137018571
US10118930, Example 463
CID 137018607
US10118930, Example 326
CID 137018650
US10118930, Example 362
CID 137018668
US10118930, Example 51
CID 137018245
US10118930, Example 83
CID 137018276

Frequently Asked Questions

What is the IUPAC name of 5-oxo-N-(oxolan-3-yl)-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of 5-oxo-N-(oxolan-3-yl)-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 137018277) is 5-oxo-N-(oxolan-3-yl)-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 5-oxo-N-(oxolan-3-yl)-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for 5-oxo-N-(oxolan-3-yl)-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidine-3-carboxamide is O=C(NC1CCOC1)c1cnn2c(C3CCNCC3)cc(=O)[nH]c12.
What is the InChIKey of 5-oxo-N-(oxolan-3-yl)-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is QHLDZELPDGJNGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N5O3/c22-14-7-13(10-1-4-17-5-2-10)21-15(20-14)12(8-18-21)16(23)19-11-3-6-24-9-11/h7-8,10-11,17H,1-6,9H2,(H,19,23)(H,20,22).
What are the key properties of 5-oxo-N-(oxolan-3-yl)-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidine-3-carboxamide?
5-oxo-N-(oxolan-3-yl)-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 331.38 g/mol, XLogP of 0.01, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxo-N-(oxolan-3-yl)-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 137018277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).