6-(4-benzylpiperidin-1-yl)-N-(2-imidazo[1,2-a]pyridin-2-ylphenyl)pyridazine-3-carboxamide

C30H28N6O — CID 121149048

IUPAC6-(4-benzylpiperidin-1-yl)-N-(2-imidazo[1,2-a]pyridin-2-ylphenyl)pyridazine-3-carboxamide
SMILESO=C(Nc1ccccc1-c1cn2ccccc2n1)c1ccc(N2CCC(Cc3ccccc3)CC2)nn1
InChIInChI=1S/C30H28N6O/c37-30(32-25-11-5-4-10-24(25)27-21-36-17-7-6-12-28(36)31-27)26-13-14-29(34-33-26)35-18-15-23(16-19-35)20-22-8-2-1-3-9-22/h1-14,17,21,23H,15-16,18-20H2,(H,32,37)
InChIKeyWFQJAEAPINZSDW-UHFFFAOYSA-N
MW488.60 g/mol
LogP5.50
Rot. Bonds6

About 6-(4-benzylpiperidin-1-yl)-N-(2-imidazo[1,2-a]pyridin-2-ylphenyl)pyridazine-3-carboxamide

6-(4-benzylpiperidin-1-yl)-N-(2-imidazo[1,2-a]pyridin-2-ylphenyl)pyridazine-3-carboxamide (PubChem CID 121149048) has the molecular formula C30H28N6O and a molecular weight of 488.60 g/mol. Its IUPAC name is 6-(4-benzylpiperidin-1-yl)-N-(2-imidazo[1,2-a]pyridin-2-ylphenyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-(4-benzylpiperidin-1-yl)-N-(2-imidazo[1,2-a]pyridin-2-ylphenyl)pyridazine-3-carboxamide
PubChem CID121149048
Molecular FormulaC30H28N6O
Molecular Weight488.60 g/mol
Exact Mass488.23
IUPAC Name6-(4-benzylpiperidin-1-yl)-N-(2-imidazo[1,2-a]pyridin-2-ylphenyl)pyridazine-3-carboxamide
SMILESO=C(Nc1ccccc1-c1cn2ccccc2n1)c1ccc(N2CCC(Cc3ccccc3)CC2)nn1
InChIInChI=1S/C30H28N6O/c37-30(32-25-11-5-4-10-24(25)27-21-36-17-7-6-12-28(36)31-27)26-13-14-29(34-33-26)35-18-15-23(16-19-35)20-22-8-2-1-3-9-22/h1-14,17,21,23H,15-16,18-20H2,(H,32,37)
InChIKeyWFQJAEAPINZSDW-UHFFFAOYSA-N
XLogP5.50
TPSA75.42 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500488.60
LogP ≤ 55.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 6-(4-benzylpiperidin-1-yl)-N-(2-imidazo[1,2-a]pyridin-2-ylphenyl)pyridazine-3-carboxamide 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

6-(4-benzylpiperidin-1-yl)-N-naphthalen-1-ylpyridazine-3-carboxamide
CID 121028392
6-(4-benzylpiperidin-1-yl)-N-pyrimidin-2-ylpyridazine-3-carboxamide
CID 121028453
6-(4-benzylpiperidin-1-yl)-N-quinolin-5-ylpyridazine-3-carboxamide
CID 121028559
6-(4-benzylpiperidin-1-yl)-N-pyridin-2-ylpyridazine-3-carboxamide
CID 121028359
6-(4-benzylpiperidin-1-yl)-N-(5-methyl-1H-pyrazol-3-yl)pyridazine-3-carboxamide
CID 71778645
6-(4-benzylpiperidin-1-yl)-N-cyclohexylpyridazine-3-carboxamide
CID 121028303
1-cyclopentyl-3-(2-imidazo[1,2-a]pyridin-2-ylphenyl)urea
CID 121149732
6-(4-benzylpiperidin-1-yl)-N-[(4-fluorophenyl)methyl]pyridazine-3-carboxamide
CID 121028384
6-(4-benzylpiperidin-1-yl)-N-(4-methyl-1,3-benzothiazol-2-yl)pyridazine-3-carboxamide
CID 121028505
N-(2-imidazo[1,2-a]pyridin-2-ylphenyl)acetamide
CID 121148942
N-(2-imidazo[1,2-a]pyridin-2-ylphenyl)pyrazine-2-carboxamide
CID 121148969
6-(4-benzylpiperidin-1-yl)-N-(furan-2-ylmethyl)pyridazine-3-carboxamide
CID 71778620

Frequently Asked Questions

What is the IUPAC name of 6-(4-benzylpiperidin-1-yl)-N-(2-imidazo[1,2-a]pyridin-2-ylphenyl)pyridazine-3-carboxamide?
The IUPAC name of 6-(4-benzylpiperidin-1-yl)-N-(2-imidazo[1,2-a]pyridin-2-ylphenyl)pyridazine-3-carboxamide (CID 121149048) is 6-(4-benzylpiperidin-1-yl)-N-(2-imidazo[1,2-a]pyridin-2-ylphenyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-(4-benzylpiperidin-1-yl)-N-(2-imidazo[1,2-a]pyridin-2-ylphenyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-(4-benzylpiperidin-1-yl)-N-(2-imidazo[1,2-a]pyridin-2-ylphenyl)pyridazine-3-carboxamide is O=C(Nc1ccccc1-c1cn2ccccc2n1)c1ccc(N2CCC(Cc3ccccc3)CC2)nn1.
What is the InChIKey of 6-(4-benzylpiperidin-1-yl)-N-(2-imidazo[1,2-a]pyridin-2-ylphenyl)pyridazine-3-carboxamide?
The InChIKey is WFQJAEAPINZSDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H28N6O/c37-30(32-25-11-5-4-10-24(25)27-21-36-17-7-6-12-28(36)31-27)26-13-14-29(34-33-26)35-18-15-23(16-19-35)20-22-8-2-1-3-9-22/h1-14,17,21,23H,15-16,18-20H2,(H,32,37).
What are the key properties of 6-(4-benzylpiperidin-1-yl)-N-(2-imidazo[1,2-a]pyridin-2-ylphenyl)pyridazine-3-carboxamide?
6-(4-benzylpiperidin-1-yl)-N-(2-imidazo[1,2-a]pyridin-2-ylphenyl)pyridazine-3-carboxamide has a molecular weight of 488.60 g/mol, XLogP of 5.50, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-benzylpiperidin-1-yl)-N-(2-imidazo[1,2-a]pyridin-2-ylphenyl)pyridazine-3-carboxamide is sourced from PubChem (CID 121149048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).