6-(propylamino)-N-thiophen-3-ylpyridine-3-sulfonamide

C12H15N3O2S2 — CID 66354410

IUPAC6-(propylamino)-N-thiophen-3-ylpyridine-3-sulfonamide
SMILESCCCNc1ccc(S(=O)(=O)Nc2ccsc2)cn1
InChIInChI=1S/C12H15N3O2S2/c1-2-6-13-12-4-3-11(8-14-12)19(16,17)15-10-5-7-18-9-10/h3-5,7-9,15H,2,6H2,1H3,(H,13,14)
InChIKeyIZMJSMKRJFMGLW-UHFFFAOYSA-N
MW297.40 g/mol
LogP2.77
Rot. Bonds6

About 6-(propylamino)-N-thiophen-3-ylpyridine-3-sulfonamide

6-(propylamino)-N-thiophen-3-ylpyridine-3-sulfonamide (PubChem CID 66354410) has the molecular formula C12H15N3O2S2 and a molecular weight of 297.40 g/mol. Its IUPAC name is 6-(propylamino)-N-thiophen-3-ylpyridine-3-sulfonamide.

Molecular Properties

Compound Name6-(propylamino)-N-thiophen-3-ylpyridine-3-sulfonamide
PubChem CID66354410
Molecular FormulaC12H15N3O2S2
Molecular Weight297.40 g/mol
Exact Mass297.06
IUPAC Name6-(propylamino)-N-thiophen-3-ylpyridine-3-sulfonamide
SMILESCCCNc1ccc(S(=O)(=O)Nc2ccsc2)cn1
InChIInChI=1S/C12H15N3O2S2/c1-2-6-13-12-4-3-11(8-14-12)19(16,17)15-10-5-7-18-9-10/h3-5,7-9,15H,2,6H2,1H3,(H,13,14)
InChIKeyIZMJSMKRJFMGLW-UHFFFAOYSA-N
XLogP2.77
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(propylamino)-N-thiophen-3-ylpyrimidine-5-sulfonamide
CID 66353570
6-hydrazinyl-N-thiophen-3-ylpyridine-3-sulfonamide
CID 66355225
N-(4-fluorophenyl)-6-(propylamino)pyridine-3-sulfonamide
CID 62145210
5-chloro-6-(propylamino)-N-thiophen-3-ylpyridine-3-sulfonamide
CID 66354828
6-(propylamino)-N-(1H-pyrazol-4-yl)pyridine-3-sulfonamide
CID 62147845
6-(propylamino)-N-(thiatriazol-5-yl)pyridine-3-sulfonamide
CID 114914131
6-(propylamino)-N-pyrazin-2-ylpyridine-3-sulfonamide
CID 62147379
N-(4,5-dimethyl-1,3-thiazol-2-yl)-6-(propylamino)pyridine-3-sulfonamide
CID 62152436
6-(propylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide
CID 116787796
N-(2-iodophenyl)-6-(propylamino)pyridine-3-sulfonamide
CID 62143908
N-(4-methyl-3-pyridinyl)-6-(propylamino)pyridine-3-sulfonamide
CID 63328166
N-[(2-methylthiolan-2-yl)methyl]-6-(propylamino)pyridine-3-sulfonamide
CID 80743899

Frequently Asked Questions

What is the IUPAC name of 6-(propylamino)-N-thiophen-3-ylpyridine-3-sulfonamide?
The IUPAC name of 6-(propylamino)-N-thiophen-3-ylpyridine-3-sulfonamide (CID 66354410) is 6-(propylamino)-N-thiophen-3-ylpyridine-3-sulfonamide.
What is the SMILES notation for 6-(propylamino)-N-thiophen-3-ylpyridine-3-sulfonamide?
The canonical SMILES for 6-(propylamino)-N-thiophen-3-ylpyridine-3-sulfonamide is CCCNc1ccc(S(=O)(=O)Nc2ccsc2)cn1.
What is the InChIKey of 6-(propylamino)-N-thiophen-3-ylpyridine-3-sulfonamide?
The InChIKey is IZMJSMKRJFMGLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O2S2/c1-2-6-13-12-4-3-11(8-14-12)19(16,17)15-10-5-7-18-9-10/h3-5,7-9,15H,2,6H2,1H3,(H,13,14).
What are the key properties of 6-(propylamino)-N-thiophen-3-ylpyridine-3-sulfonamide?
6-(propylamino)-N-thiophen-3-ylpyridine-3-sulfonamide has a molecular weight of 297.40 g/mol, XLogP of 2.77, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(propylamino)-N-thiophen-3-ylpyridine-3-sulfonamide is sourced from PubChem (CID 66354410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).