1-[6-(4-methylphenyl)pyridazin-3-yl]-N-phenylpiperidine-3-carboxamide

C23H24N4O — CID 53025060

IUPAC1-[6-(4-methylphenyl)pyridazin-3-yl]-N-phenylpiperidine-3-carboxamide
SMILESCc1ccc(-c2ccc(N3CCCC(C(=O)Nc4ccccc4)C3)nn2)cc1
InChIInChI=1S/C23H24N4O/c1-17-9-11-18(12-10-17)21-13-14-22(26-25-21)27-15-5-6-19(16-27)23(28)24-20-7-3-2-4-8-20/h2-4,7-14,19H,5-6,15-16H2,1H3,(H,24,28)
InChIKeyMZXRBIUXHBVYDV-UHFFFAOYSA-N
MW372.47 g/mol
LogP4.31
Rot. Bonds4

About 1-[6-(4-methylphenyl)pyridazin-3-yl]-N-phenylpiperidine-3-carboxamide

1-[6-(4-methylphenyl)pyridazin-3-yl]-N-phenylpiperidine-3-carboxamide (PubChem CID 53025060) has the molecular formula C23H24N4O and a molecular weight of 372.47 g/mol. Its IUPAC name is 1-[6-(4-methylphenyl)pyridazin-3-yl]-N-phenylpiperidine-3-carboxamide.

Molecular Properties

Compound Name1-[6-(4-methylphenyl)pyridazin-3-yl]-N-phenylpiperidine-3-carboxamide
PubChem CID53025060
Molecular FormulaC23H24N4O
Molecular Weight372.47 g/mol
Exact Mass372.20
IUPAC Name1-[6-(4-methylphenyl)pyridazin-3-yl]-N-phenylpiperidine-3-carboxamide
SMILESCc1ccc(-c2ccc(N3CCCC(C(=O)Nc4ccccc4)C3)nn2)cc1
InChIInChI=1S/C23H24N4O/c1-17-9-11-18(12-10-17)21-13-14-22(26-25-21)27-15-5-6-19(16-27)23(28)24-20-7-3-2-4-8-20/h2-4,7-14,19H,5-6,15-16H2,1H3,(H,24,28)
InChIKeyMZXRBIUXHBVYDV-UHFFFAOYSA-N
XLogP4.31
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 ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[6-(4-methylphenyl)pyridazin-3-yl]-N-phenylpiperidine-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

(3S)-N-(4-methoxyphenyl)-1-[6-(4-methylphenyl)pyridazin-3-yl]piperidine-3-carboxamide
CID 93055834
N-(4-anilinophenyl)-1-[6-(4-chlorophenyl)pyridazin-3-yl]piperidine-3-carboxamide
CID 121071550
(3S)-1-(6-phenylpyridazin-3-yl)-N-(4-propan-2-ylphenyl)piperidine-3-carboxamide
CID 30351004
(3S)-N-(3-acetamidophenyl)-1-(6-phenylpyridazin-3-yl)piperidine-3-carboxamide
CID 30866093
(3S)-N-(4-chlorophenyl)-1-(6-phenylpyridazin-3-yl)piperidine-3-carboxamide
CID 30351128
(3R)-1-[6-(4-fluorophenyl)pyridazin-3-yl]-N-(3-methylphenyl)piperidine-3-carboxamide
CID 30353811
(3S)-N-(3-acetylphenyl)-1-(6-phenylpyridazin-3-yl)piperidine-3-carboxamide
CID 30866083
(3R)-N-(4-nitrophenyl)-1-(6-phenylpyridazin-3-yl)piperidine-3-carboxamide
CID 30866078
N-pyridin-4-yl-1-(6-pyridin-4-ylpyridazin-3-yl)piperidine-3-carboxamide
CID 121070781
(3S)-N-cyclopropyl-1-[6-(4-methylphenyl)pyridazin-3-yl]piperidine-3-carboxamide
CID 93055724
N-cyclopentyl-1-[6-(4-methylphenyl)pyridazin-3-yl]piperidine-3-carboxamide
CID 53004870
(3S)-N-cyclopentyl-1-[6-(4-methylphenyl)pyridazin-3-yl]piperidine-3-carboxamide
CID 93055740

Frequently Asked Questions

What is the IUPAC name of 1-[6-(4-methylphenyl)pyridazin-3-yl]-N-phenylpiperidine-3-carboxamide?
The IUPAC name of 1-[6-(4-methylphenyl)pyridazin-3-yl]-N-phenylpiperidine-3-carboxamide (CID 53025060) is 1-[6-(4-methylphenyl)pyridazin-3-yl]-N-phenylpiperidine-3-carboxamide.
What is the SMILES notation for 1-[6-(4-methylphenyl)pyridazin-3-yl]-N-phenylpiperidine-3-carboxamide?
The canonical SMILES for 1-[6-(4-methylphenyl)pyridazin-3-yl]-N-phenylpiperidine-3-carboxamide is Cc1ccc(-c2ccc(N3CCCC(C(=O)Nc4ccccc4)C3)nn2)cc1.
What is the InChIKey of 1-[6-(4-methylphenyl)pyridazin-3-yl]-N-phenylpiperidine-3-carboxamide?
The InChIKey is MZXRBIUXHBVYDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O/c1-17-9-11-18(12-10-17)21-13-14-22(26-25-21)27-15-5-6-19(16-27)23(28)24-20-7-3-2-4-8-20/h2-4,7-14,19H,5-6,15-16H2,1H3,(H,24,28).
What are the key properties of 1-[6-(4-methylphenyl)pyridazin-3-yl]-N-phenylpiperidine-3-carboxamide?
1-[6-(4-methylphenyl)pyridazin-3-yl]-N-phenylpiperidine-3-carboxamide has a molecular weight of 372.47 g/mol, XLogP of 4.31, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(4-methylphenyl)pyridazin-3-yl]-N-phenylpiperidine-3-carboxamide is sourced from PubChem (CID 53025060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).