N-[3-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]-2-naphthalen-1-ylacetamide

C28H28N4O — CID 43991523

IUPACN-[3-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]-2-naphthalen-1-ylacetamide
SMILESCC1CCN(c2ccc(-c3cccc(NC(=O)Cc4cccc5ccccc45)c3)nn2)CC1
InChIInChI=1S/C28H28N4O/c1-20-14-16-32(17-15-20)27-13-12-26(30-31-27)23-9-5-10-24(18-23)29-28(33)19-22-8-4-7-21-6-2-3-11-25(21)22/h2-13,18,20H,14-17,19H2,1H3,(H,29,33)
InChIKeyUUKKOLZCEXZCCJ-UHFFFAOYSA-N
MW436.56 g/mol
LogP5.71
Rot. Bonds5

About N-[3-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]-2-naphthalen-1-ylacetamide

N-[3-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]-2-naphthalen-1-ylacetamide (PubChem CID 43991523) has the molecular formula C28H28N4O and a molecular weight of 436.56 g/mol. Its IUPAC name is N-[3-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]-2-naphthalen-1-ylacetamide.

Molecular Properties

Compound NameN-[3-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]-2-naphthalen-1-ylacetamide
PubChem CID43991523
Molecular FormulaC28H28N4O
Molecular Weight436.56 g/mol
Exact Mass436.23
IUPAC NameN-[3-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]-2-naphthalen-1-ylacetamide
SMILESCC1CCN(c2ccc(-c3cccc(NC(=O)Cc4cccc5ccccc45)c3)nn2)CC1
InChIInChI=1S/C28H28N4O/c1-20-14-16-32(17-15-20)27-13-12-26(30-31-27)23-9-5-10-24(18-23)29-28(33)19-22-8-4-7-21-6-2-3-11-25(21)22/h2-13,18,20H,14-17,19H2,1H3,(H,29,33)
InChIKeyUUKKOLZCEXZCCJ-UHFFFAOYSA-N
XLogP5.71
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500436.56
LogP ≤ 55.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[3-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]-2-naphthalen-1-ylacetamide 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

2-(2-chlorophenoxy)-N-[3-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]acetamide
CID 43991488
1-(2-methylphenyl)-3-[3-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]urea
CID 43991572
N-[3-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]-4-phenylbenzamide
CID 43991300
2-(3,5-dimethoxyphenoxy)-N-[3-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]acetamide
CID 43991495
2,2,2-trifluoro-N-[3-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]acetamide
CID 7422385
N-[4-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-2-naphthalen-1-ylacetamide
CID 43992248
2-(4-ethylphenoxy)-N-[3-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]acetamide
CID 43991501
2-(4-tert-butylphenoxy)-N-[3-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]acetamide
CID 43991479
2-bromo-N-[3-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]benzamide
CID 41077570
N-[3-[6-(4-methylpiperazin-1-yl)pyridazin-3-yl]phenyl]-2-phenylacetamide
CID 7593151
3-methyl-N-[3-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]benzamide
CID 41077581
1-(4-ethoxyphenyl)-3-[3-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]urea
CID 43991571

Frequently Asked Questions

What is the IUPAC name of N-[3-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]-2-naphthalen-1-ylacetamide?
The IUPAC name of N-[3-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]-2-naphthalen-1-ylacetamide (CID 43991523) is N-[3-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]-2-naphthalen-1-ylacetamide.
What is the SMILES notation for N-[3-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]-2-naphthalen-1-ylacetamide?
The canonical SMILES for N-[3-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]-2-naphthalen-1-ylacetamide is CC1CCN(c2ccc(-c3cccc(NC(=O)Cc4cccc5ccccc45)c3)nn2)CC1.
What is the InChIKey of N-[3-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]-2-naphthalen-1-ylacetamide?
The InChIKey is UUKKOLZCEXZCCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H28N4O/c1-20-14-16-32(17-15-20)27-13-12-26(30-31-27)23-9-5-10-24(18-23)29-28(33)19-22-8-4-7-21-6-2-3-11-25(21)22/h2-13,18,20H,14-17,19H2,1H3,(H,29,33).
What are the key properties of N-[3-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]-2-naphthalen-1-ylacetamide?
N-[3-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]-2-naphthalen-1-ylacetamide has a molecular weight of 436.56 g/mol, XLogP of 5.71, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]-2-naphthalen-1-ylacetamide is sourced from PubChem (CID 43991523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).