4-(3-methyl-1,2-oxazol-5-yl)-1-(1-methylpiperidin-4-yl)-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one

C16H21N5O2 — CID 169415772

IUPAC4-(3-methyl-1,2-oxazol-5-yl)-1-(1-methylpiperidin-4-yl)-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one
SMILESCc1cc(C2CC(=O)Nc3c2cnn3C2CCN(C)CC2)on1
InChIInChI=1S/C16H21N5O2/c1-10-7-14(23-19-10)12-8-15(22)18-16-13(12)9-17-21(16)11-3-5-20(2)6-4-11/h7,9,11-12H,3-6,8H2,1-2H3,(H,18,22)
InChIKeyOQTWFXOKOCYJDU-UHFFFAOYSA-N
MW315.38 g/mol
LogP1.92
Rot. Bonds2

About 4-(3-methyl-1,2-oxazol-5-yl)-1-(1-methylpiperidin-4-yl)-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one

4-(3-methyl-1,2-oxazol-5-yl)-1-(1-methylpiperidin-4-yl)-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one (PubChem CID 169415772) has the molecular formula C16H21N5O2 and a molecular weight of 315.38 g/mol. Its IUPAC name is 4-(3-methyl-1,2-oxazol-5-yl)-1-(1-methylpiperidin-4-yl)-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one.

Molecular Properties

Compound Name4-(3-methyl-1,2-oxazol-5-yl)-1-(1-methylpiperidin-4-yl)-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one
PubChem CID169415772
Molecular FormulaC16H21N5O2
Molecular Weight315.38 g/mol
Exact Mass315.17
IUPAC Name4-(3-methyl-1,2-oxazol-5-yl)-1-(1-methylpiperidin-4-yl)-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one
SMILESCc1cc(C2CC(=O)Nc3c2cnn3C2CCN(C)CC2)on1
InChIInChI=1S/C16H21N5O2/c1-10-7-14(23-19-10)12-8-15(22)18-16-13(12)9-17-21(16)11-3-5-20(2)6-4-11/h7,9,11-12H,3-6,8H2,1-2H3,(H,18,22)
InChIKeyOQTWFXOKOCYJDU-UHFFFAOYSA-N
XLogP1.92
TPSA76.19 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.38
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-(1-methylpiperidin-4-yl)-4-(2-oxo-1H-pyridin-3-yl)-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one
CID 169416102
4-imidazo[1,2-a]pyridin-3-yl-1-(1-methylpiperidin-4-yl)-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one
CID 170505398
(4S)-4-(3-methyl-1-benzothiophen-2-yl)-1-(1-methylpiperidin-4-yl)-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one
CID 136737671
(4R)-1-cyclopentyl-4-(3,5-dimethyl-1,2-oxazol-4-yl)-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one
CID 136887461
4-(1-methyl-3-phenylpyrazol-4-yl)-1-(1-methylpiperidin-4-yl)-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one
CID 169421979
1-cyclopentyl-4-(3,5-difluorophenyl)-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one
CID 169412915
(4S)-4-[(E)-1-(furan-2-yl)prop-1-en-2-yl]-1-(1-methylpiperidin-4-yl)-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one
CID 136697876
8-methyl-4-(3-methyl-1,2-oxazol-5-yl)-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinolin-2-one
CID 169419497
1-cyclopentyl-4-(3,4,5-trimethoxyphenyl)-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one
CID 135632536
(4R)-1-cyclopentyl-4-(4-methylsulfonylphenyl)-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one
CID 136800408
(4R)-4-(6-chloro-1,3-benzodioxol-5-yl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one
CID 136737756
1-methyl-4-(5-phenylfuran-2-yl)-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one
CID 135632453

Frequently Asked Questions

What is the IUPAC name of 4-(3-methyl-1,2-oxazol-5-yl)-1-(1-methylpiperidin-4-yl)-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one?
The IUPAC name of 4-(3-methyl-1,2-oxazol-5-yl)-1-(1-methylpiperidin-4-yl)-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one (CID 169415772) is 4-(3-methyl-1,2-oxazol-5-yl)-1-(1-methylpiperidin-4-yl)-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one.
What is the SMILES notation for 4-(3-methyl-1,2-oxazol-5-yl)-1-(1-methylpiperidin-4-yl)-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one?
The canonical SMILES for 4-(3-methyl-1,2-oxazol-5-yl)-1-(1-methylpiperidin-4-yl)-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one is Cc1cc(C2CC(=O)Nc3c2cnn3C2CCN(C)CC2)on1.
What is the InChIKey of 4-(3-methyl-1,2-oxazol-5-yl)-1-(1-methylpiperidin-4-yl)-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one?
The InChIKey is OQTWFXOKOCYJDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N5O2/c1-10-7-14(23-19-10)12-8-15(22)18-16-13(12)9-17-21(16)11-3-5-20(2)6-4-11/h7,9,11-12H,3-6,8H2,1-2H3,(H,18,22).
What are the key properties of 4-(3-methyl-1,2-oxazol-5-yl)-1-(1-methylpiperidin-4-yl)-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one?
4-(3-methyl-1,2-oxazol-5-yl)-1-(1-methylpiperidin-4-yl)-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one has a molecular weight of 315.38 g/mol, XLogP of 1.92, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methyl-1,2-oxazol-5-yl)-1-(1-methylpiperidin-4-yl)-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one is sourced from PubChem (CID 169415772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).