N-[4-(2-oxopyrrolidin-1-yl)phenyl]-6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide

C29H24N6O2 — CID 26708715

IUPACN-[4-(2-oxopyrrolidin-1-yl)phenyl]-6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide
SMILESO=C(Nc1ccc(N2CCCC2=O)cc1)c1cc(-c2ccccc2)nc2c1cnn2Cc1ccncc1
InChIInChI=1S/C29H24N6O2/c36-27-7-4-16-34(27)23-10-8-22(9-11-23)32-29(37)24-17-26(21-5-2-1-3-6-21)33-28-25(24)18-31-35(28)19-20-12-14-30-15-13-20/h1-3,5-6,8-15,17-18H,4,7,16,19H2,(H,32,37)
InChIKeySGJZZWCAVBMGON-UHFFFAOYSA-N
MW488.55 g/mol
LogP4.92
Rot. Bonds6

About N-[4-(2-oxopyrrolidin-1-yl)phenyl]-6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide

N-[4-(2-oxopyrrolidin-1-yl)phenyl]-6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 26708715) has the molecular formula C29H24N6O2 and a molecular weight of 488.55 g/mol. Its IUPAC name is N-[4-(2-oxopyrrolidin-1-yl)phenyl]-6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[4-(2-oxopyrrolidin-1-yl)phenyl]-6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide
PubChem CID26708715
Molecular FormulaC29H24N6O2
Molecular Weight488.55 g/mol
Exact Mass488.20
IUPAC NameN-[4-(2-oxopyrrolidin-1-yl)phenyl]-6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide
SMILESO=C(Nc1ccc(N2CCCC2=O)cc1)c1cc(-c2ccccc2)nc2c1cnn2Cc1ccncc1
InChIInChI=1S/C29H24N6O2/c36-27-7-4-16-34(27)23-10-8-22(9-11-23)32-29(37)24-17-26(21-5-2-1-3-6-21)33-28-25(24)18-31-35(28)19-20-12-14-30-15-13-20/h1-3,5-6,8-15,17-18H,4,7,16,19H2,(H,32,37)
InChIKeySGJZZWCAVBMGON-UHFFFAOYSA-N
XLogP4.92
TPSA93.01 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms37
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500488.55
LogP ≤ 54.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(1R)-1-cyclopropylethyl]-6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide
CID 41042469
N,N-diethyl-6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide
CID 25336169
N-(4-carbamoylphenyl)-1-[(3-fluorophenyl)methyl]-6-phenylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 26689268
1-benzyl-N-(2-methylsulfonylphenyl)-6-phenylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 55535001
2-chloro-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 7686374
N-[3-chloro-4-(3-oxopiperazin-1-yl)phenyl]-1-ethyl-6-phenylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 55661587
1-benzyl-N-(6-methyl-2-oxo-1H-pyrimidin-4-yl)-6-phenylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 166199022
1-benzyl-6-(4-methylphenyl)pyrazolo[5,4-b]pyridine-4-carboxylic acid
CID 113220360
N-(4-cyanophenyl)-1-ethyl-6-phenylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 16590998
N-(1-benzylpyrazol-4-yl)-1-ethyl-6-phenylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 55982114
1-benzyl-N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide
CID 24625383
1-ethyl-N-(1-ethyl-6-oxo-3-pyridinyl)-6-phenylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 60556984

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-oxopyrrolidin-1-yl)phenyl]-6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide?
The IUPAC name of N-[4-(2-oxopyrrolidin-1-yl)phenyl]-6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide (CID 26708715) is N-[4-(2-oxopyrrolidin-1-yl)phenyl]-6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide.
What is the SMILES notation for N-[4-(2-oxopyrrolidin-1-yl)phenyl]-6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide?
The canonical SMILES for N-[4-(2-oxopyrrolidin-1-yl)phenyl]-6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide is O=C(Nc1ccc(N2CCCC2=O)cc1)c1cc(-c2ccccc2)nc2c1cnn2Cc1ccncc1.
What is the InChIKey of N-[4-(2-oxopyrrolidin-1-yl)phenyl]-6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide?
The InChIKey is SGJZZWCAVBMGON-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H24N6O2/c36-27-7-4-16-34(27)23-10-8-22(9-11-23)32-29(37)24-17-26(21-5-2-1-3-6-21)33-28-25(24)18-31-35(28)19-20-12-14-30-15-13-20/h1-3,5-6,8-15,17-18H,4,7,16,19H2,(H,32,37).
What are the key properties of N-[4-(2-oxopyrrolidin-1-yl)phenyl]-6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide?
N-[4-(2-oxopyrrolidin-1-yl)phenyl]-6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 488.55 g/mol, XLogP of 4.92, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-oxopyrrolidin-1-yl)phenyl]-6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 26708715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).