5-pyridin-2-yl-N-(thiophen-2-ylmethylideneamino)thiophene-2-sulfonamide

C14H11N3O2S3 — CID 2820420

IUPAC5-pyridin-2-yl-N-(thiophen-2-ylmethylideneamino)thiophene-2-sulfonamide
SMILESO=S(=O)(NN=Cc1cccs1)c1ccc(-c2ccccn2)s1
InChIInChI=1S/C14H11N3O2S3/c18-22(19,17-16-10-11-4-3-9-20-11)14-7-6-13(21-14)12-5-1-2-8-15-12/h1-10,17H
InChIKeyNQLLICVDQBVFSB-UHFFFAOYSA-N
MW349.46 g/mol
LogP3.18
Rot. Bonds5

About 5-pyridin-2-yl-N-(thiophen-2-ylmethylideneamino)thiophene-2-sulfonamide

5-pyridin-2-yl-N-(thiophen-2-ylmethylideneamino)thiophene-2-sulfonamide (PubChem CID 2820420) has the molecular formula C14H11N3O2S3 and a molecular weight of 349.46 g/mol. Its IUPAC name is 5-pyridin-2-yl-N-(thiophen-2-ylmethylideneamino)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-pyridin-2-yl-N-(thiophen-2-ylmethylideneamino)thiophene-2-sulfonamide
PubChem CID2820420
Molecular FormulaC14H11N3O2S3
Molecular Weight349.46 g/mol
Exact Mass349.00
IUPAC Name5-pyridin-2-yl-N-(thiophen-2-ylmethylideneamino)thiophene-2-sulfonamide
SMILESO=S(=O)(NN=Cc1cccs1)c1ccc(-c2ccccn2)s1
InChIInChI=1S/C14H11N3O2S3/c18-22(19,17-16-10-11-4-3-9-20-11)14-7-6-13(21-14)12-5-1-2-8-15-12/h1-10,17H
InChIKeyNQLLICVDQBVFSB-UHFFFAOYSA-N
XLogP3.18
TPSA71.42 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.46
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[4,5-dichloro-2-(thiophen-2-ylsulfonylamino)phenyl]-5-pyridin-2-ylthiophene-2-sulfonamide
CID 67970190
5-pyridin-2-yl-N-[(2-thiophen-2-yl-1,3-thiazol-4-yl)methyl]thiophene-2-sulfonamide
CID 2738763
4-chloro-N-(thiophen-2-ylmethylideneamino)benzenesulfonamide
CID 874023
2,4,6-trimethyl-N-[(E)-thiophen-2-ylmethylideneamino]benzenesulfonamide
CID 110516904
N-(thiophen-2-ylmethylideneamino)pyridine-2-carboxamide
CID 760257
2-[5-(trifluoromethylsulfonyl)thiophen-2-yl]pyridine
CID 70975076
4-methoxy-N-[(Z)-thiophen-2-ylmethylideneamino]benzenesulfonamide
CID 5407738
5-pyridin-2-yl-N-(1H-pyrrolo[2,3-b]pyridin-2-ylmethyl)thiophene-2-sulfonamide
CID 58087312
5-pyridin-2-yl-N-[(4-sulfamoylphenyl)methyl]thiophene-2-sulfonamide
CID 2738724
platinum;bis(2-thiophen-2-ylpyridine)
CID 87764255
3,4-dimethoxy-N-[(E)-thiophen-2-ylmethylideneamino]benzenesulfonamide
CID 110517561
2-[5-[5-(5-pyridin-2-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]pyridine
CID 102384658

Frequently Asked Questions

What is the IUPAC name of 5-pyridin-2-yl-N-(thiophen-2-ylmethylideneamino)thiophene-2-sulfonamide?
The IUPAC name of 5-pyridin-2-yl-N-(thiophen-2-ylmethylideneamino)thiophene-2-sulfonamide (CID 2820420) is 5-pyridin-2-yl-N-(thiophen-2-ylmethylideneamino)thiophene-2-sulfonamide.
What is the SMILES notation for 5-pyridin-2-yl-N-(thiophen-2-ylmethylideneamino)thiophene-2-sulfonamide?
The canonical SMILES for 5-pyridin-2-yl-N-(thiophen-2-ylmethylideneamino)thiophene-2-sulfonamide is O=S(=O)(NN=Cc1cccs1)c1ccc(-c2ccccn2)s1.
What is the InChIKey of 5-pyridin-2-yl-N-(thiophen-2-ylmethylideneamino)thiophene-2-sulfonamide?
The InChIKey is NQLLICVDQBVFSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N3O2S3/c18-22(19,17-16-10-11-4-3-9-20-11)14-7-6-13(21-14)12-5-1-2-8-15-12/h1-10,17H.
What are the key properties of 5-pyridin-2-yl-N-(thiophen-2-ylmethylideneamino)thiophene-2-sulfonamide?
5-pyridin-2-yl-N-(thiophen-2-ylmethylideneamino)thiophene-2-sulfonamide has a molecular weight of 349.46 g/mol, XLogP of 3.18, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pyridin-2-yl-N-(thiophen-2-ylmethylideneamino)thiophene-2-sulfonamide is sourced from PubChem (CID 2820420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).