N-[3-(6-methoxypyridazin-3-yl)phenyl]thiophene-2-carboxamide

C16H13N3O2S — CID 7593509

IUPACN-[3-(6-methoxypyridazin-3-yl)phenyl]thiophene-2-carboxamide
SMILESCOc1ccc(-c2cccc(NC(=O)c3cccs3)c2)nn1
InChIInChI=1S/C16H13N3O2S/c1-21-15-8-7-13(18-19-15)11-4-2-5-12(10-11)17-16(20)14-6-3-9-22-14/h2-10H,1H3,(H,17,20)
InChIKeyWDNWZNLYSQRAEY-UHFFFAOYSA-N
MW311.37 g/mol
LogP3.47
Rot. Bonds4

About N-[3-(6-methoxypyridazin-3-yl)phenyl]thiophene-2-carboxamide

N-[3-(6-methoxypyridazin-3-yl)phenyl]thiophene-2-carboxamide (PubChem CID 7593509) has the molecular formula C16H13N3O2S and a molecular weight of 311.37 g/mol. Its IUPAC name is N-[3-(6-methoxypyridazin-3-yl)phenyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[3-(6-methoxypyridazin-3-yl)phenyl]thiophene-2-carboxamide
PubChem CID7593509
Molecular FormulaC16H13N3O2S
Molecular Weight311.37 g/mol
Exact Mass311.07
IUPAC NameN-[3-(6-methoxypyridazin-3-yl)phenyl]thiophene-2-carboxamide
SMILESCOc1ccc(-c2cccc(NC(=O)c3cccs3)c2)nn1
InChIInChI=1S/C16H13N3O2S/c1-21-15-8-7-13(18-19-15)11-4-2-5-12(10-11)17-16(20)14-6-3-9-22-14/h2-10H,1H3,(H,17,20)
InChIKeyWDNWZNLYSQRAEY-UHFFFAOYSA-N
XLogP3.47
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.37
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[3-(6-methoxypyridazin-3-yl)phenyl]thiophene-2-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

2-[6-(4-Methoxyphenyl)pyridazin-3-yl]sulfanyl-1-thiophen-2-ylethanone
CID 7205890
N-(3-methoxybenzyl)-2-[(6-thien-2-ylpyridazin-3-yl)thio]acetamide
CID 16194270
N-[3-(6-ethoxypyridazin-3-yl)phenyl]thiophene-2-carboxamide
CID 7422527
Methyl 4-(2-{[6-(thiophen-2-YL)pyridazin-3-YL]sulfanyl}acetamido)benzoate
CID 16019268
2-[[6-(2-furanyl)-3-pyridazinyl]thio]-N-(3-methylphenyl)acetamide
CID 7207114
N-(3-acetylphenyl)-2-[6-(furan-2-yl)pyridazin-3-yl]sulfanylacetamide
CID 7207250
N-(4-methoxyphenyl)-2-((6-(thiophen-2-yl)pyridazin-3-yl)thio)acetamide
CID 16019264
N-(3-acetylphenyl)-2-((6-(3,4-dimethoxyphenyl)pyridazin-3-yl)thio)acetamide
CID 16188115
N-(4-((4-(p-tolyl)phthalazin-1-yl)oxy)phenyl)thiophene-2-carboxamide
CID 6403492
N-(3-(6-methoxypyridazin-3-yl)phenyl)benzamide
CID 7422501
N-(2-Methoxy-5-methylphenyl)-2-{[6-(thiophen-2-YL)pyridazin-3-YL]sulfanyl}acetamide
CID 20900465
N-(2-((6-phenylpyridazin-3-yl)oxy)ethyl)thiophene-2-carboxamide
CID 41527453

Frequently Asked Questions

What is the IUPAC name of N-[3-(6-methoxypyridazin-3-yl)phenyl]thiophene-2-carboxamide?
The IUPAC name of N-[3-(6-methoxypyridazin-3-yl)phenyl]thiophene-2-carboxamide (CID 7593509) is N-[3-(6-methoxypyridazin-3-yl)phenyl]thiophene-2-carboxamide.
What is the SMILES notation for N-[3-(6-methoxypyridazin-3-yl)phenyl]thiophene-2-carboxamide?
The canonical SMILES for N-[3-(6-methoxypyridazin-3-yl)phenyl]thiophene-2-carboxamide is COc1ccc(-c2cccc(NC(=O)c3cccs3)c2)nn1.
What is the InChIKey of N-[3-(6-methoxypyridazin-3-yl)phenyl]thiophene-2-carboxamide?
The InChIKey is WDNWZNLYSQRAEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3O2S/c1-21-15-8-7-13(18-19-15)11-4-2-5-12(10-11)17-16(20)14-6-3-9-22-14/h2-10H,1H3,(H,17,20).
What are the key properties of N-[3-(6-methoxypyridazin-3-yl)phenyl]thiophene-2-carboxamide?
N-[3-(6-methoxypyridazin-3-yl)phenyl]thiophene-2-carboxamide has a molecular weight of 311.37 g/mol, XLogP of 3.47, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(6-methoxypyridazin-3-yl)phenyl]thiophene-2-carboxamide is sourced from PubChem (CID 7593509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).