3-[1-[1-(tetrazolo[1,5-b]pyridazin-6-yl)piperidine-4-carbonyl]piperidin-4-yl]-1,3-dihydroindol-2-one

C23H26N8O2 — CID 154805794

IUPAC3-[1-[1-(tetrazolo[1,5-b]pyridazin-6-yl)piperidine-4-carbonyl]piperidin-4-yl]-1,3-dihydroindol-2-one
SMILESO=C1Nc2ccccc2C1C1CCN(C(=O)C2CCN(c3ccc4nnnn4n3)CC2)CC1
InChIInChI=1S/C23H26N8O2/c32-22-21(17-3-1-2-4-18(17)24-22)15-7-13-30(14-8-15)23(33)16-9-11-29(12-10-16)20-6-5-19-25-27-28-31(19)26-20/h1-6,15-16,21H,7-14H2,(H,24,32)
InChIKeyYCUOGNDMSMEETM-UHFFFAOYSA-N
MW446.52 g/mol
LogP1.71
Rot. Bonds3

About 3-[1-[1-(tetrazolo[1,5-b]pyridazin-6-yl)piperidine-4-carbonyl]piperidin-4-yl]-1,3-dihydroindol-2-one

3-[1-[1-(tetrazolo[1,5-b]pyridazin-6-yl)piperidine-4-carbonyl]piperidin-4-yl]-1,3-dihydroindol-2-one (PubChem CID 154805794) has the molecular formula C23H26N8O2 and a molecular weight of 446.52 g/mol. Its IUPAC name is 3-[1-[1-(tetrazolo[1,5-b]pyridazin-6-yl)piperidine-4-carbonyl]piperidin-4-yl]-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name3-[1-[1-(tetrazolo[1,5-b]pyridazin-6-yl)piperidine-4-carbonyl]piperidin-4-yl]-1,3-dihydroindol-2-one
PubChem CID154805794
Molecular FormulaC23H26N8O2
Molecular Weight446.52 g/mol
Exact Mass446.22
IUPAC Name3-[1-[1-(tetrazolo[1,5-b]pyridazin-6-yl)piperidine-4-carbonyl]piperidin-4-yl]-1,3-dihydroindol-2-one
SMILESO=C1Nc2ccccc2C1C1CCN(C(=O)C2CCN(c3ccc4nnnn4n3)CC2)CC1
InChIInChI=1S/C23H26N8O2/c32-22-21(17-3-1-2-4-18(17)24-22)15-7-13-30(14-8-15)23(33)16-9-11-29(12-10-16)20-6-5-19-25-27-28-31(19)26-20/h1-6,15-16,21H,7-14H2,(H,24,32)
InChIKeyYCUOGNDMSMEETM-UHFFFAOYSA-N
XLogP1.71
TPSA108.62 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500446.52
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 3-[1-[1-(tetrazolo[1,5-b]pyridazin-6-yl)piperidine-4-carbonyl]piperidin-4-yl]-1,3-dihydroindol-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[1-(cyclopentanecarbonyl)piperidin-4-yl]-1,3-dihydroindol-2-one
CID 110710761
[4-[(2-fluorophenyl)methylidene]piperidin-1-yl]-[1-(tetrazolo[1,5-b]pyridazin-6-yl)piperidin-4-yl]methanone
CID 154839175
3-[1-(9-aminobicyclo[3.3.1]nonane-3-carbonyl)piperidin-4-yl]-1,3-dihydroindol-2-one
CID 120988636
[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]-[1-(tetrazolo[1,5-b]pyridazin-6-yl)piperidin-4-yl]methanone
CID 24666317
[4-[(5-phenylthiophen-2-yl)methyl]piperazin-1-yl]-[1-(tetrazolo[1,5-b]pyridazin-6-yl)piperidin-4-yl]methanone
CID 30839314
3-[1-[2-(4-methylpiperazin-1-yl)pyridine-4-carbonyl]piperidin-4-yl]-1,3-dihydroindol-2-one
CID 154806869
N-ethyl-N-naphthalen-1-yl-1-(tetrazolo[1,5-b]pyridazin-6-yl)piperidine-4-carboxamide
CID 78861446
6-[4-(1H-indol-3-yl)piperidin-1-yl]tetrazolo[1,5-b]pyridazine
CID 134036776
tert-butyl (3R)-3-[(3S)-2-oxo-1,3-dihydroindol-3-yl]pyrrolidine-1-carboxylate
CID 98060720
3-[1-(5-methyl-1,3-oxazole-4-carbonyl)piperidin-4-yl]-1,3-dihydroindol-2-one
CID 154747405
6-(4-phenylazepan-1-yl)tetrazolo[1,5-b]pyridazine
CID 133286661
N-phenyl-N-prop-2-enyl-1-(tetrazolo[1,5-b]pyridazin-6-yl)piperidine-4-carboxamide
CID 30822093

Frequently Asked Questions

What is the IUPAC name of 3-[1-[1-(tetrazolo[1,5-b]pyridazin-6-yl)piperidine-4-carbonyl]piperidin-4-yl]-1,3-dihydroindol-2-one?
The IUPAC name of 3-[1-[1-(tetrazolo[1,5-b]pyridazin-6-yl)piperidine-4-carbonyl]piperidin-4-yl]-1,3-dihydroindol-2-one (CID 154805794) is 3-[1-[1-(tetrazolo[1,5-b]pyridazin-6-yl)piperidine-4-carbonyl]piperidin-4-yl]-1,3-dihydroindol-2-one.
What is the SMILES notation for 3-[1-[1-(tetrazolo[1,5-b]pyridazin-6-yl)piperidine-4-carbonyl]piperidin-4-yl]-1,3-dihydroindol-2-one?
The canonical SMILES for 3-[1-[1-(tetrazolo[1,5-b]pyridazin-6-yl)piperidine-4-carbonyl]piperidin-4-yl]-1,3-dihydroindol-2-one is O=C1Nc2ccccc2C1C1CCN(C(=O)C2CCN(c3ccc4nnnn4n3)CC2)CC1.
What is the InChIKey of 3-[1-[1-(tetrazolo[1,5-b]pyridazin-6-yl)piperidine-4-carbonyl]piperidin-4-yl]-1,3-dihydroindol-2-one?
The InChIKey is YCUOGNDMSMEETM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N8O2/c32-22-21(17-3-1-2-4-18(17)24-22)15-7-13-30(14-8-15)23(33)16-9-11-29(12-10-16)20-6-5-19-25-27-28-31(19)26-20/h1-6,15-16,21H,7-14H2,(H,24,32).
What are the key properties of 3-[1-[1-(tetrazolo[1,5-b]pyridazin-6-yl)piperidine-4-carbonyl]piperidin-4-yl]-1,3-dihydroindol-2-one?
3-[1-[1-(tetrazolo[1,5-b]pyridazin-6-yl)piperidine-4-carbonyl]piperidin-4-yl]-1,3-dihydroindol-2-one has a molecular weight of 446.52 g/mol, XLogP of 1.71, 3 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-[1-(tetrazolo[1,5-b]pyridazin-6-yl)piperidine-4-carbonyl]piperidin-4-yl]-1,3-dihydroindol-2-one is sourced from PubChem (CID 154805794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).