3-methyl-N-[4-(6-piperidin-1-ylpyridazin-3-yl)phenyl]benzamide

C23H24N4O — CID 8670441

IUPAC3-methyl-N-[4-(6-piperidin-1-ylpyridazin-3-yl)phenyl]benzamide
SMILESCc1cccc(C(=O)Nc2ccc(-c3ccc(N4CCCCC4)nn3)cc2)c1
InChIInChI=1S/C23H24N4O/c1-17-6-5-7-19(16-17)23(28)24-20-10-8-18(9-11-20)21-12-13-22(26-25-21)27-14-3-2-4-15-27/h5-13,16H,2-4,14-15H2,1H3,(H,24,28)
InChIKeyVZPCVMQSLKOMJH-UHFFFAOYSA-N
MW372.47 g/mol
LogP4.69
Rot. Bonds4

About 3-methyl-N-[4-(6-piperidin-1-ylpyridazin-3-yl)phenyl]benzamide

3-methyl-N-[4-(6-piperidin-1-ylpyridazin-3-yl)phenyl]benzamide (PubChem CID 8670441) has the molecular formula C23H24N4O and a molecular weight of 372.47 g/mol. Its IUPAC name is 3-methyl-N-[4-(6-piperidin-1-ylpyridazin-3-yl)phenyl]benzamide.

Molecular Properties

Compound Name3-methyl-N-[4-(6-piperidin-1-ylpyridazin-3-yl)phenyl]benzamide
PubChem CID8670441
Molecular FormulaC23H24N4O
Molecular Weight372.47 g/mol
Exact Mass372.20
IUPAC Name3-methyl-N-[4-(6-piperidin-1-ylpyridazin-3-yl)phenyl]benzamide
SMILESCc1cccc(C(=O)Nc2ccc(-c3ccc(N4CCCCC4)nn3)cc2)c1
InChIInChI=1S/C23H24N4O/c1-17-6-5-7-19(16-17)23(28)24-20-10-8-18(9-11-20)21-12-13-22(26-25-21)27-14-3-2-4-15-27/h5-13,16H,2-4,14-15H2,1H3,(H,24,28)
InChIKeyVZPCVMQSLKOMJH-UHFFFAOYSA-N
XLogP4.69
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.47
LogP ≤ 54.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-methylphenyl)-4-(6-pyrrolidin-1-ylpyridazin-3-yl)benzamide
CID 53098734
N-[4-(6-piperidin-1-ylpyridazin-3-yl)phenyl]benzamide
CID 8670425
N-[4-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-3,4-dimethylbenzamide
CID 41077843
N-[4-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-4-phenylbenzamide
CID 43992160
N-(4-methoxyphenyl)-3-(6-pyrrolidin-1-ylpyridazin-3-yl)benzamide
CID 50816225
1-(4-methylphenyl)-3-[4-(6-piperidin-1-ylpyridazin-3-yl)phenyl]urea
CID 43992694
N-[4-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-4-tert-butylbenzamide
CID 43992152
3-methyl-N-[3-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]benzamide
CID 41077581
N-[4-(6-piperidin-1-ylpyridazin-3-yl)phenyl]-1,3-benzodioxole-5-carboxamide
CID 7593475
3,5-dimethyl-N-[4-[6-(4-methylpiperazin-4-ium-1-yl)pyridazin-3-yl]phenyl]benzamide
CID 7593450
N-[4-(6-piperidin-1-ylpyridazin-3-yl)phenyl]-4-(trifluoromethyl)benzamide
CID 41089324
N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-3-bromobenzamide
CID 25301822

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[4-(6-piperidin-1-ylpyridazin-3-yl)phenyl]benzamide?
The IUPAC name of 3-methyl-N-[4-(6-piperidin-1-ylpyridazin-3-yl)phenyl]benzamide (CID 8670441) is 3-methyl-N-[4-(6-piperidin-1-ylpyridazin-3-yl)phenyl]benzamide.
What is the SMILES notation for 3-methyl-N-[4-(6-piperidin-1-ylpyridazin-3-yl)phenyl]benzamide?
The canonical SMILES for 3-methyl-N-[4-(6-piperidin-1-ylpyridazin-3-yl)phenyl]benzamide is Cc1cccc(C(=O)Nc2ccc(-c3ccc(N4CCCCC4)nn3)cc2)c1.
What is the InChIKey of 3-methyl-N-[4-(6-piperidin-1-ylpyridazin-3-yl)phenyl]benzamide?
The InChIKey is VZPCVMQSLKOMJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O/c1-17-6-5-7-19(16-17)23(28)24-20-10-8-18(9-11-20)21-12-13-22(26-25-21)27-14-3-2-4-15-27/h5-13,16H,2-4,14-15H2,1H3,(H,24,28).
What are the key properties of 3-methyl-N-[4-(6-piperidin-1-ylpyridazin-3-yl)phenyl]benzamide?
3-methyl-N-[4-(6-piperidin-1-ylpyridazin-3-yl)phenyl]benzamide has a molecular weight of 372.47 g/mol, XLogP of 4.69, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[4-(6-piperidin-1-ylpyridazin-3-yl)phenyl]benzamide is sourced from PubChem (CID 8670441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).