3-(7-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-2-yl)-1H-pyridin-2-one

C16H17N5O — CID 167436102

IUPAC3-(7-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-2-yl)-1H-pyridin-2-one
SMILESO=c1[nH]cccc1-c1cc2nccc(C3CCCNC3)n2n1
InChIInChI=1S/C16H17N5O/c22-16-12(4-2-7-19-16)13-9-15-18-8-5-14(21(15)20-13)11-3-1-6-17-10-11/h2,4-5,7-9,11,17H,1,3,6,10H2,(H,19,22)
InChIKeyBHCBREVDINYCCG-UHFFFAOYSA-N
MW295.35 g/mol
LogP1.55
Rot. Bonds2

About 3-(7-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-2-yl)-1H-pyridin-2-one

3-(7-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-2-yl)-1H-pyridin-2-one (PubChem CID 167436102) has the molecular formula C16H17N5O and a molecular weight of 295.35 g/mol. Its IUPAC name is 3-(7-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-2-yl)-1H-pyridin-2-one.

Molecular Properties

Compound Name3-(7-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-2-yl)-1H-pyridin-2-one
PubChem CID167436102
Molecular FormulaC16H17N5O
Molecular Weight295.35 g/mol
Exact Mass295.14
IUPAC Name3-(7-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-2-yl)-1H-pyridin-2-one
SMILESO=c1[nH]cccc1-c1cc2nccc(C3CCCNC3)n2n1
InChIInChI=1S/C16H17N5O/c22-16-12(4-2-7-19-16)13-9-15-18-8-5-14(21(15)20-13)11-3-1-6-17-10-11/h2,4-5,7-9,11,17H,1,3,6,10H2,(H,19,22)
InChIKeyBHCBREVDINYCCG-UHFFFAOYSA-N
XLogP1.55
TPSA75.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.35
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

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CID 24865424
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CID 16670089
7-piperidin-3-yl-2-propylpyrazolo[1,5-a]pyrimidine
CID 103315962
2-(2-methylpropyl)-7-piperidin-3-ylpyrazolo[1,5-a]pyrimidine
CID 103316447
2-(3-methylphenyl)-7-piperidin-4-ylpyrazolo[1,5-a]pyrimidine
CID 110244538
7-pyrrolidin-3-ylpyrazolo[1,5-a]pyrimidine
CID 82404951
7-piperidin-3-yl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine;hydrochloride
CID 46737117
2-(4-chlorophenyl)-7-cyclopropylpyrazolo[1,5-a]pyrimidine
CID 86760503
2-methyl-3-[(E)-2-phenylethenyl]-7-[(3S)-piperidin-3-yl]pyrazolo[1,5-a]pyrimidine
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5-piperidin-3-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 115030706
3-(2-methylpyrimidin-4-yl)-5-piperidin-3-yl-1,2,4-oxadiazole
CID 113329250
3-(3-cyclopropyl-1-methylpyrazol-5-yl)piperidine
CID 83833173

Frequently Asked Questions

What is the IUPAC name of 3-(7-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-2-yl)-1H-pyridin-2-one?
The IUPAC name of 3-(7-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-2-yl)-1H-pyridin-2-one (CID 167436102) is 3-(7-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-2-yl)-1H-pyridin-2-one.
What is the SMILES notation for 3-(7-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-2-yl)-1H-pyridin-2-one?
The canonical SMILES for 3-(7-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-2-yl)-1H-pyridin-2-one is O=c1[nH]cccc1-c1cc2nccc(C3CCCNC3)n2n1.
What is the InChIKey of 3-(7-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-2-yl)-1H-pyridin-2-one?
The InChIKey is BHCBREVDINYCCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N5O/c22-16-12(4-2-7-19-16)13-9-15-18-8-5-14(21(15)20-13)11-3-1-6-17-10-11/h2,4-5,7-9,11,17H,1,3,6,10H2,(H,19,22).
What are the key properties of 3-(7-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-2-yl)-1H-pyridin-2-one?
3-(7-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-2-yl)-1H-pyridin-2-one has a molecular weight of 295.35 g/mol, XLogP of 1.55, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(7-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-2-yl)-1H-pyridin-2-one is sourced from PubChem (CID 167436102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).