4-methyl-7-(2-oxo-2-pyrrolidin-1-ylethyl)-1,3-diphenylpyrazolo[5,4-b]pyridin-6-one

C25H24N4O2 — CID 22575737

IUPAC4-methyl-7-(2-oxo-2-pyrrolidin-1-ylethyl)-1,3-diphenylpyrazolo[5,4-b]pyridin-6-one
SMILESCc1cc(=O)n(CC(=O)N2CCCC2)c2c1c(-c1ccccc1)nn2-c1ccccc1
InChIInChI=1S/C25H24N4O2/c1-18-16-21(30)28(17-22(31)27-14-8-9-15-27)25-23(18)24(19-10-4-2-5-11-19)26-29(25)20-12-6-3-7-13-20/h2-7,10-13,16H,8-9,14-15,17H2,1H3
InChIKeyRWRXRJIWEBPJNL-UHFFFAOYSA-N
MW412.49 g/mol
LogP3.79
Rot. Bonds4

About 4-methyl-7-(2-oxo-2-pyrrolidin-1-ylethyl)-1,3-diphenylpyrazolo[5,4-b]pyridin-6-one

4-methyl-7-(2-oxo-2-pyrrolidin-1-ylethyl)-1,3-diphenylpyrazolo[5,4-b]pyridin-6-one (PubChem CID 22575737) has the molecular formula C25H24N4O2 and a molecular weight of 412.49 g/mol. Its IUPAC name is 4-methyl-7-(2-oxo-2-pyrrolidin-1-ylethyl)-1,3-diphenylpyrazolo[5,4-b]pyridin-6-one.

Molecular Properties

Compound Name4-methyl-7-(2-oxo-2-pyrrolidin-1-ylethyl)-1,3-diphenylpyrazolo[5,4-b]pyridin-6-one
PubChem CID22575737
Molecular FormulaC25H24N4O2
Molecular Weight412.49 g/mol
Exact Mass412.19
IUPAC Name4-methyl-7-(2-oxo-2-pyrrolidin-1-ylethyl)-1,3-diphenylpyrazolo[5,4-b]pyridin-6-one
SMILESCc1cc(=O)n(CC(=O)N2CCCC2)c2c1c(-c1ccccc1)nn2-c1ccccc1
InChIInChI=1S/C25H24N4O2/c1-18-16-21(30)28(17-22(31)27-14-8-9-15-27)25-23(18)24(19-10-4-2-5-11-19)26-29(25)20-12-6-3-7-13-20/h2-7,10-13,16H,8-9,14-15,17H2,1H3
InChIKeyRWRXRJIWEBPJNL-UHFFFAOYSA-N
XLogP3.79
TPSA60.13 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.49
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 4-methyl-7-(2-oxo-2-pyrrolidin-1-ylethyl)-1,3-diphenylpyrazolo[5,4-b]pyridin-6-one with MolForge

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Related Compounds

N-[2-(4-chlorophenyl)ethyl]-2-(4-methyl-6-oxo-1,3-diphenylpyrazolo[5,4-b]pyridin-7-yl)acetamide
CID 22575738
2-(3,4-dimethyl-6-oxo-1-phenylpyrazolo[5,4-b]pyridin-7-yl)acetamide
CID 9147641
N-(5-chloro-2-methylphenyl)-2-[4-methyl-3-(3-methylphenyl)-6-oxo-1-phenylpyrazolo[5,4-b]pyridin-7-yl]acetamide
CID 20939921
3-methyl-1-(4-methylphenyl)-7-(2-oxo-2-piperidin-1-ylethyl)-4-(trifluoromethyl)pyrazolo[5,4-b]pyridin-6-one
CID 46339101
4-methyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)quinolin-2-one
CID 39768041
2-(4-methyl-1,3-diphenylpyrazolo[5,4-b]pyridin-6-yl)oxy-1-(4-methylpiperazin-1-yl)ethanone
CID 50799159
3,4-dimethyl-7-pentyl-1-phenylpyrazolo[5,4-b]pyridin-6-one
CID 9146991
3,4-dimethyl-7-(2-morpholin-4-ylethyl)-1-phenylpyrazolo[5,4-b]pyridin-6-one
CID 9147164
2-(2-chlorophenyl)-4-(2-oxo-2-pyrrolidin-1-ylethyl)-5-phenyl-1,2,4-triazol-3-one
CID 70708002
3,4-dimethyl-1-phenyl-7-(2-piperidin-1-ium-1-ylethyl)pyrazolo[5,4-b]pyridin-6-one
CID 9147141
N-(3,4-dimethylphenyl)-2-(3-methyl-6-oxo-1,4-diphenylpyrazolo[5,4-b]pyridin-7-yl)acetamide
CID 22575759
6-[2-(3,4-dimethyl-6-oxo-1-phenylpyrazolo[5,4-b]pyridin-7-yl)acetyl]-4-ethyl-1,4-benzoxazin-3-one
CID 27261620

Frequently Asked Questions

What is the IUPAC name of 4-methyl-7-(2-oxo-2-pyrrolidin-1-ylethyl)-1,3-diphenylpyrazolo[5,4-b]pyridin-6-one?
The IUPAC name of 4-methyl-7-(2-oxo-2-pyrrolidin-1-ylethyl)-1,3-diphenylpyrazolo[5,4-b]pyridin-6-one (CID 22575737) is 4-methyl-7-(2-oxo-2-pyrrolidin-1-ylethyl)-1,3-diphenylpyrazolo[5,4-b]pyridin-6-one.
What is the SMILES notation for 4-methyl-7-(2-oxo-2-pyrrolidin-1-ylethyl)-1,3-diphenylpyrazolo[5,4-b]pyridin-6-one?
The canonical SMILES for 4-methyl-7-(2-oxo-2-pyrrolidin-1-ylethyl)-1,3-diphenylpyrazolo[5,4-b]pyridin-6-one is Cc1cc(=O)n(CC(=O)N2CCCC2)c2c1c(-c1ccccc1)nn2-c1ccccc1.
What is the InChIKey of 4-methyl-7-(2-oxo-2-pyrrolidin-1-ylethyl)-1,3-diphenylpyrazolo[5,4-b]pyridin-6-one?
The InChIKey is RWRXRJIWEBPJNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N4O2/c1-18-16-21(30)28(17-22(31)27-14-8-9-15-27)25-23(18)24(19-10-4-2-5-11-19)26-29(25)20-12-6-3-7-13-20/h2-7,10-13,16H,8-9,14-15,17H2,1H3.
What are the key properties of 4-methyl-7-(2-oxo-2-pyrrolidin-1-ylethyl)-1,3-diphenylpyrazolo[5,4-b]pyridin-6-one?
4-methyl-7-(2-oxo-2-pyrrolidin-1-ylethyl)-1,3-diphenylpyrazolo[5,4-b]pyridin-6-one has a molecular weight of 412.49 g/mol, XLogP of 3.79, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-7-(2-oxo-2-pyrrolidin-1-ylethyl)-1,3-diphenylpyrazolo[5,4-b]pyridin-6-one is sourced from PubChem (CID 22575737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).