1-benzyl-6-oxo-N-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)-4,5-dihydropyridazine-3-carboxamide

C24H23N5O2 — CID 55758251

IUPAC1-benzyl-6-oxo-N-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)-4,5-dihydropyridazine-3-carboxamide
SMILESO=C(Nc1c2c(nn1-c1ccccc1)CCC2)C1=NN(Cc2ccccc2)C(=O)CC1
InChIInChI=1S/C24H23N5O2/c30-22-15-14-21(26-28(22)16-17-8-3-1-4-9-17)24(31)25-23-19-12-7-13-20(19)27-29(23)18-10-5-2-6-11-18/h1-6,8-11H,7,12-16H2,(H,25,31)
InChIKeyVWPRQAPDLVGREQ-UHFFFAOYSA-N
MW413.48 g/mol
LogP3.48
Rot. Bonds5

About 1-benzyl-6-oxo-N-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)-4,5-dihydropyridazine-3-carboxamide

1-benzyl-6-oxo-N-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)-4,5-dihydropyridazine-3-carboxamide (PubChem CID 55758251) has the molecular formula C24H23N5O2 and a molecular weight of 413.48 g/mol. Its IUPAC name is 1-benzyl-6-oxo-N-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)-4,5-dihydropyridazine-3-carboxamide.

Molecular Properties

Compound Name1-benzyl-6-oxo-N-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)-4,5-dihydropyridazine-3-carboxamide
PubChem CID55758251
Molecular FormulaC24H23N5O2
Molecular Weight413.48 g/mol
Exact Mass413.19
IUPAC Name1-benzyl-6-oxo-N-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)-4,5-dihydropyridazine-3-carboxamide
SMILESO=C(Nc1c2c(nn1-c1ccccc1)CCC2)C1=NN(Cc2ccccc2)C(=O)CC1
InChIInChI=1S/C24H23N5O2/c30-22-15-14-21(26-28(22)16-17-8-3-1-4-9-17)24(31)25-23-19-12-7-13-20(19)27-29(23)18-10-5-2-6-11-18/h1-6,8-11H,7,12-16H2,(H,25,31)
InChIKeyVWPRQAPDLVGREQ-UHFFFAOYSA-N
XLogP3.48
TPSA79.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500413.48
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4,5-dichloro-1-methyl-N-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)pyrrole-2-carboxamide
CID 56808607
3,4-difluoro-N-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)benzamide
CID 43036733
2-chloro-4-fluoro-N-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)benzamide
CID 30007109
1-benzyl-N-(5-benzyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-6-oxo-4,5-dihydropyridazine-3-carboxamide
CID 55756077
1-benzyl-N-(4-methyl-2-pyridinyl)-6-oxo-4,5-dihydropyridazine-3-carboxamide
CID 60555152
1-benzyl-N-[3-(dimethylcarbamoyl)phenyl]-6-oxo-4,5-dihydropyridazine-3-carboxamide
CID 55741614
2-(methoxymethyl)-N-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)-1,3-thiazole-4-carboxamide
CID 48574488
1-benzyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-oxo-4,5-dihydropyridazine-3-carboxamide
CID 55741600
4-(difluoromethylsulfonyl)-N-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)benzamide
CID 55475933
2-(difluoromethoxy)-N-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)benzamide
CID 30007381
2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-N-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)acetamide
CID 30007660
1-benzyl-6-oxo-N'-(1H-pyrrole-2-carbonyl)-4,5-dihydropyridazine-3-carbohydrazide
CID 78879861

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-6-oxo-N-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)-4,5-dihydropyridazine-3-carboxamide?
The IUPAC name of 1-benzyl-6-oxo-N-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)-4,5-dihydropyridazine-3-carboxamide (CID 55758251) is 1-benzyl-6-oxo-N-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)-4,5-dihydropyridazine-3-carboxamide.
What is the SMILES notation for 1-benzyl-6-oxo-N-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)-4,5-dihydropyridazine-3-carboxamide?
The canonical SMILES for 1-benzyl-6-oxo-N-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)-4,5-dihydropyridazine-3-carboxamide is O=C(Nc1c2c(nn1-c1ccccc1)CCC2)C1=NN(Cc2ccccc2)C(=O)CC1.
What is the InChIKey of 1-benzyl-6-oxo-N-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)-4,5-dihydropyridazine-3-carboxamide?
The InChIKey is VWPRQAPDLVGREQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N5O2/c30-22-15-14-21(26-28(22)16-17-8-3-1-4-9-17)24(31)25-23-19-12-7-13-20(19)27-29(23)18-10-5-2-6-11-18/h1-6,8-11H,7,12-16H2,(H,25,31).
What are the key properties of 1-benzyl-6-oxo-N-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)-4,5-dihydropyridazine-3-carboxamide?
1-benzyl-6-oxo-N-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)-4,5-dihydropyridazine-3-carboxamide has a molecular weight of 413.48 g/mol, XLogP of 3.48, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-6-oxo-N-(2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)-4,5-dihydropyridazine-3-carboxamide is sourced from PubChem (CID 55758251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).