3-chloro-N-[1-[3-(6-methoxypyridazin-3-yl)benzoyl]piperidin-4-yl]benzamide

C24H23ClN4O3 — CID 134800906

IUPAC3-chloro-N-[1-[3-(6-methoxypyridazin-3-yl)benzoyl]piperidin-4-yl]benzamide
SMILESCOc1ccc(-c2cccc(C(=O)N3CCC(NC(=O)c4cccc(Cl)c4)CC3)c2)nn1
InChIInChI=1S/C24H23ClN4O3/c1-32-22-9-8-21(27-28-22)16-4-2-6-18(14-16)24(31)29-12-10-20(11-13-29)26-23(30)17-5-3-7-19(25)15-17/h2-9,14-15,20H,10-13H2,1H3,(H,26,30)
InChIKeyHTBFKZVLALWNJZ-UHFFFAOYSA-N
MW450.93 g/mol
LogP3.84
Rot. Bonds5

About 3-chloro-N-[1-[3-(6-methoxypyridazin-3-yl)benzoyl]piperidin-4-yl]benzamide

3-chloro-N-[1-[3-(6-methoxypyridazin-3-yl)benzoyl]piperidin-4-yl]benzamide (PubChem CID 134800906) has the molecular formula C24H23ClN4O3 and a molecular weight of 450.93 g/mol. Its IUPAC name is 3-chloro-N-[1-[3-(6-methoxypyridazin-3-yl)benzoyl]piperidin-4-yl]benzamide.

Molecular Properties

Compound Name3-chloro-N-[1-[3-(6-methoxypyridazin-3-yl)benzoyl]piperidin-4-yl]benzamide
PubChem CID134800906
Molecular FormulaC24H23ClN4O3
Molecular Weight450.93 g/mol
Exact Mass450.15
IUPAC Name3-chloro-N-[1-[3-(6-methoxypyridazin-3-yl)benzoyl]piperidin-4-yl]benzamide
SMILESCOc1ccc(-c2cccc(C(=O)N3CCC(NC(=O)c4cccc(Cl)c4)CC3)c2)nn1
InChIInChI=1S/C24H23ClN4O3/c1-32-22-9-8-21(27-28-22)16-4-2-6-18(14-16)24(31)29-12-10-20(11-13-29)26-23(30)17-5-3-7-19(25)15-17/h2-9,14-15,20H,10-13H2,1H3,(H,26,30)
InChIKeyHTBFKZVLALWNJZ-UHFFFAOYSA-N
XLogP3.84
TPSA84.42 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500450.93
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-chloro-N-[1-[3-(6-methoxypyridazin-3-yl)benzoyl]piperidin-4-yl]benzamide 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

N-[1-[3-(6-methoxypyridazin-3-yl)benzoyl]piperidin-4-yl]benzamide
CID 134803358
2-chloro-N-[1-[3-(6-methoxypyridazin-3-yl)benzoyl]piperidin-4-yl]benzamide
CID 134800868
N-[1-[3-(6-methoxypyridazin-3-yl)benzoyl]piperidin-4-yl]-2-methylbenzamide
CID 134801985
2-methoxy-N-[1-[3-(6-methoxypyridazin-3-yl)benzoyl]piperidin-4-yl]benzamide
CID 134803210
N-[1-(3-chlorobenzoyl)piperidin-4-yl]-3,4-dimethoxybenzamide
CID 108548796
3-chloro-N-[1-(4-chlorobenzoyl)piperidin-4-yl]benzamide
CID 108550681
1-[3-(6-methoxypyridazin-3-yl)benzoyl]piperidine-4-carbonitrile
CID 134803644
N-[1-(3-chlorobenzoyl)piperidin-4-yl]-4-propan-2-ylbenzamide
CID 108564146
N-cyclopropyl-3-[6-(2-methoxyphenoxy)pyridazin-3-yl]benzamide
CID 46387034
N-[1-[4-(6-methoxypyridazin-3-yl)benzoyl]piperidin-4-yl]acetamide
CID 134801644
3-chloro-N-[1-(3,4,5-trihydroxybenzoyl)piperidin-4-yl]benzamide
CID 108550695
N-[1-(3-chlorobenzoyl)piperidin-4-yl]pyridine-2-carboxamide
CID 110821025

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-[1-[3-(6-methoxypyridazin-3-yl)benzoyl]piperidin-4-yl]benzamide?
The IUPAC name of 3-chloro-N-[1-[3-(6-methoxypyridazin-3-yl)benzoyl]piperidin-4-yl]benzamide (CID 134800906) is 3-chloro-N-[1-[3-(6-methoxypyridazin-3-yl)benzoyl]piperidin-4-yl]benzamide.
What is the SMILES notation for 3-chloro-N-[1-[3-(6-methoxypyridazin-3-yl)benzoyl]piperidin-4-yl]benzamide?
The canonical SMILES for 3-chloro-N-[1-[3-(6-methoxypyridazin-3-yl)benzoyl]piperidin-4-yl]benzamide is COc1ccc(-c2cccc(C(=O)N3CCC(NC(=O)c4cccc(Cl)c4)CC3)c2)nn1.
What is the InChIKey of 3-chloro-N-[1-[3-(6-methoxypyridazin-3-yl)benzoyl]piperidin-4-yl]benzamide?
The InChIKey is HTBFKZVLALWNJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23ClN4O3/c1-32-22-9-8-21(27-28-22)16-4-2-6-18(14-16)24(31)29-12-10-20(11-13-29)26-23(30)17-5-3-7-19(25)15-17/h2-9,14-15,20H,10-13H2,1H3,(H,26,30).
What are the key properties of 3-chloro-N-[1-[3-(6-methoxypyridazin-3-yl)benzoyl]piperidin-4-yl]benzamide?
3-chloro-N-[1-[3-(6-methoxypyridazin-3-yl)benzoyl]piperidin-4-yl]benzamide has a molecular weight of 450.93 g/mol, XLogP of 3.84, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-[1-[3-(6-methoxypyridazin-3-yl)benzoyl]piperidin-4-yl]benzamide is sourced from PubChem (CID 134800906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).