1-(4-methoxyphenyl)-7-oxo-6-[3-(2-oxopiperidin-1-yl)-3-azabicyclo[3.1.0]hexan-6-yl]-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide

C24H28N6O4 — CID 118535813

IUPAC1-(4-methoxyphenyl)-7-oxo-6-[3-(2-oxopiperidin-1-yl)-3-azabicyclo[3.1.0]hexan-6-yl]-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide
SMILESCOc1ccc(-n2nc(C(N)=O)c3c2C(=O)N(C2C4CN(N5CCCCC5=O)CC42)CC3)cc1
InChIInChI=1S/C24H28N6O4/c1-34-15-7-5-14(6-8-15)30-22-16(20(26-30)23(25)32)9-11-28(24(22)33)21-17-12-27(13-18(17)21)29-10-3-2-4-19(29)31/h5-8,17-18,21H,2-4,9-13H2,1H3,(H2,25,32)
InChIKeyALYJYWCADZZSPS-UHFFFAOYSA-N
MW464.53 g/mol
LogP0.84
Rot. Bonds5

About 1-(4-methoxyphenyl)-7-oxo-6-[3-(2-oxopiperidin-1-yl)-3-azabicyclo[3.1.0]hexan-6-yl]-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide

1-(4-methoxyphenyl)-7-oxo-6-[3-(2-oxopiperidin-1-yl)-3-azabicyclo[3.1.0]hexan-6-yl]-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide (PubChem CID 118535813) has the molecular formula C24H28N6O4 and a molecular weight of 464.53 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-7-oxo-6-[3-(2-oxopiperidin-1-yl)-3-azabicyclo[3.1.0]hexan-6-yl]-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-7-oxo-6-[3-(2-oxopiperidin-1-yl)-3-azabicyclo[3.1.0]hexan-6-yl]-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide
PubChem CID118535813
Molecular FormulaC24H28N6O4
Molecular Weight464.53 g/mol
Exact Mass464.22
IUPAC Name1-(4-methoxyphenyl)-7-oxo-6-[3-(2-oxopiperidin-1-yl)-3-azabicyclo[3.1.0]hexan-6-yl]-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide
SMILESCOc1ccc(-n2nc(C(N)=O)c3c2C(=O)N(C2C4CN(N5CCCCC5=O)CC42)CC3)cc1
InChIInChI=1S/C24H28N6O4/c1-34-15-7-5-14(6-8-15)30-22-16(20(26-30)23(25)32)9-11-28(24(22)33)21-17-12-27(13-18(17)21)29-10-3-2-4-19(29)31/h5-8,17-18,21H,2-4,9-13H2,1H3,(H2,25,32)
InChIKeyALYJYWCADZZSPS-UHFFFAOYSA-N
XLogP0.84
TPSA114.00 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500464.53
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 1-(4-methoxyphenyl)-7-oxo-6-[3-(2-oxopiperidin-1-yl)-3-azabicyclo[3.1.0]hexan-6-yl]-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide with MolForge

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Related Compounds

3-acetyl-1-(4-methoxyphenyl)-6-[1-(2-oxopiperidin-1-yl)piperidin-4-yl]-4,5-dihydropyrazolo[5,4-c]pyridin-7-one
CID 129174549
3-acetyl-1-(4-methoxyphenyl)-6-[4-(2-oxopiperidin-1-yl)phenyl]-4,5-dihydropyrazolo[5,4-c]pyridin-7-one;1-(4-methoxyphenyl)-7-oxo-6-[4-(2-oxopiperidin-1-yl)phenyl]-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide;1-(4-methoxyphenyl)-7-oxo-6-[4-(2-oxopiperidin-1-yl)phenyl]-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid
CID 158695238
1-(4-methoxyphenyl)-7-oxo-6-[[4-(2-oxopiperidin-1-yl)phenyl]methyl]-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide
CID 163543726
N,N-dideuterio-1-(4-methoxyphenyl)-7-oxo-6-[4-(2-oxopiperidin-1-yl)phenyl]-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide
CID 25208012
1-(4-methoxyphenyl)-7-oxo-6-[4-(2-oxoazepan-1-yl)phenyl]-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid
CID 175000389
1-(4-methoxyphenyl)-7-oxo-6-[1-[2-(pyrrolidin-1-ylmethyl)phenyl]piperidin-4-yl]-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide
CID 23648152
1-(4-methoxyphenyl)-6-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide
CID 118086878
6-[4-[4-[3-carbamoyl-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridin-6-yl]-N-hydroxyanilino]phenyl]-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide
CID 126495801
1-(4-methoxyphenyl)-7-oxo-6-[4-(1-pyrrolidin-1-ylcyclopropyl)phenyl]-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide
CID 59020077
4,4-dideuterio-6-[4-(3,3-dideuterio-2-oxopiperidin-1-yl)phenyl]-1-(4-methoxyphenyl)-7-oxo-5H-pyrazolo[5,4-c]pyridine-3-carboxamide
CID 89059681
6-[4-(3,3,4,4,5,5-hexadeuterio-2-oxopiperidin-1-yl)phenyl]-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide
CID 89059700
1-(2,4-dimethoxyphenyl)-7-oxo-6-[4-(2-oxopiperidin-1-yl)phenyl]-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide
CID 118086903

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-7-oxo-6-[3-(2-oxopiperidin-1-yl)-3-azabicyclo[3.1.0]hexan-6-yl]-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide?
The IUPAC name of 1-(4-methoxyphenyl)-7-oxo-6-[3-(2-oxopiperidin-1-yl)-3-azabicyclo[3.1.0]hexan-6-yl]-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide (CID 118535813) is 1-(4-methoxyphenyl)-7-oxo-6-[3-(2-oxopiperidin-1-yl)-3-azabicyclo[3.1.0]hexan-6-yl]-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide.
What is the SMILES notation for 1-(4-methoxyphenyl)-7-oxo-6-[3-(2-oxopiperidin-1-yl)-3-azabicyclo[3.1.0]hexan-6-yl]-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide?
The canonical SMILES for 1-(4-methoxyphenyl)-7-oxo-6-[3-(2-oxopiperidin-1-yl)-3-azabicyclo[3.1.0]hexan-6-yl]-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide is COc1ccc(-n2nc(C(N)=O)c3c2C(=O)N(C2C4CN(N5CCCCC5=O)CC42)CC3)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)-7-oxo-6-[3-(2-oxopiperidin-1-yl)-3-azabicyclo[3.1.0]hexan-6-yl]-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide?
The InChIKey is ALYJYWCADZZSPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N6O4/c1-34-15-7-5-14(6-8-15)30-22-16(20(26-30)23(25)32)9-11-28(24(22)33)21-17-12-27(13-18(17)21)29-10-3-2-4-19(29)31/h5-8,17-18,21H,2-4,9-13H2,1H3,(H2,25,32).
What are the key properties of 1-(4-methoxyphenyl)-7-oxo-6-[3-(2-oxopiperidin-1-yl)-3-azabicyclo[3.1.0]hexan-6-yl]-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide?
1-(4-methoxyphenyl)-7-oxo-6-[3-(2-oxopiperidin-1-yl)-3-azabicyclo[3.1.0]hexan-6-yl]-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide has a molecular weight of 464.53 g/mol, XLogP of 0.84, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-7-oxo-6-[3-(2-oxopiperidin-1-yl)-3-azabicyclo[3.1.0]hexan-6-yl]-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide is sourced from PubChem (CID 118535813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).