5-(aminomethyl)-N-pyridazin-3-ylthiophene-3-sulfonamide

C9H10N4O2S2 — CID 106084044

IUPAC5-(aminomethyl)-N-pyridazin-3-ylthiophene-3-sulfonamide
SMILESNCc1cc(S(=O)(=O)Nc2cccnn2)cs1
InChIInChI=1S/C9H10N4O2S2/c10-5-7-4-8(6-16-7)17(14,15)13-9-2-1-3-11-12-9/h1-4,6H,5,10H2,(H,12,13)
InChIKeyWBYCHDCIQVMMOO-UHFFFAOYSA-N
MW270.34 g/mol
LogP0.80
Rot. Bonds4

About 5-(aminomethyl)-N-pyridazin-3-ylthiophene-3-sulfonamide

5-(aminomethyl)-N-pyridazin-3-ylthiophene-3-sulfonamide (PubChem CID 106084044) has the molecular formula C9H10N4O2S2 and a molecular weight of 270.34 g/mol. Its IUPAC name is 5-(aminomethyl)-N-pyridazin-3-ylthiophene-3-sulfonamide.

Molecular Properties

Compound Name5-(aminomethyl)-N-pyridazin-3-ylthiophene-3-sulfonamide
PubChem CID106084044
Molecular FormulaC9H10N4O2S2
Molecular Weight270.34 g/mol
Exact Mass270.02
IUPAC Name5-(aminomethyl)-N-pyridazin-3-ylthiophene-3-sulfonamide
SMILESNCc1cc(S(=O)(=O)Nc2cccnn2)cs1
InChIInChI=1S/C9H10N4O2S2/c10-5-7-4-8(6-16-7)17(14,15)13-9-2-1-3-11-12-9/h1-4,6H,5,10H2,(H,12,13)
InChIKeyWBYCHDCIQVMMOO-UHFFFAOYSA-N
XLogP0.80
TPSA97.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5-(aminomethyl)-N-pyridin-2-ylthiophene-3-sulfonamide
CID 106082397
4-(aminomethyl)-N-pyridazin-3-ylthiophene-2-sulfonamide
CID 106084249
5-(aminomethyl)-N-(2-iodophenyl)thiophene-3-sulfonamide
CID 106030161
5-(aminomethyl)-N-(2-bromophenyl)thiophene-3-sulfonamide
CID 106061159
5-(aminomethyl)-N-(pyridin-4-ylmethyl)thiophene-3-sulfonamide
CID 114138779
4-methyl-N-pyridazin-3-ylbenzenesulfonamide
CID 118115921
5-(aminomethyl)-2-fluoro-N-pyridazin-3-ylbenzenesulfonamide
CID 106084095
5-(aminomethyl)-N-(2,5-difluorophenyl)thiophene-3-sulfonamide
CID 106058021
5-(aminomethyl)-N-(4-methylsulfanylphenyl)thiophene-3-sulfonamide
CID 106057752
5-(aminomethyl)-N-(2,6-dibromo-4-methylphenyl)thiophene-3-sulfonamide
CID 106001955
5-(aminomethyl)-N-(4-bromo-2-methylphenyl)thiophene-3-sulfonamide
CID 106057499
5-(aminomethyl)-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]thiophene-3-sulfonamide
CID 106262509

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-N-pyridazin-3-ylthiophene-3-sulfonamide?
The IUPAC name of 5-(aminomethyl)-N-pyridazin-3-ylthiophene-3-sulfonamide (CID 106084044) is 5-(aminomethyl)-N-pyridazin-3-ylthiophene-3-sulfonamide.
What is the SMILES notation for 5-(aminomethyl)-N-pyridazin-3-ylthiophene-3-sulfonamide?
The canonical SMILES for 5-(aminomethyl)-N-pyridazin-3-ylthiophene-3-sulfonamide is NCc1cc(S(=O)(=O)Nc2cccnn2)cs1.
What is the InChIKey of 5-(aminomethyl)-N-pyridazin-3-ylthiophene-3-sulfonamide?
The InChIKey is WBYCHDCIQVMMOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4O2S2/c10-5-7-4-8(6-16-7)17(14,15)13-9-2-1-3-11-12-9/h1-4,6H,5,10H2,(H,12,13).
What are the key properties of 5-(aminomethyl)-N-pyridazin-3-ylthiophene-3-sulfonamide?
5-(aminomethyl)-N-pyridazin-3-ylthiophene-3-sulfonamide has a molecular weight of 270.34 g/mol, XLogP of 0.80, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-N-pyridazin-3-ylthiophene-3-sulfonamide is sourced from PubChem (CID 106084044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).