3-amino-N-(1-thiophen-3-ylpropan-2-yl)pyridine-2-sulfonamide

C12H15N3O2S2 — CID 103305478

IUPAC3-amino-N-(1-thiophen-3-ylpropan-2-yl)pyridine-2-sulfonamide
SMILESCC(Cc1ccsc1)NS(=O)(=O)c1ncccc1N
InChIInChI=1S/C12H15N3O2S2/c1-9(7-10-4-6-18-8-10)15-19(16,17)12-11(13)3-2-5-14-12/h2-6,8-9,15H,7,13H2,1H3
InChIKeyXNXAKFJWSTUSMB-UHFFFAOYSA-N
MW297.40 g/mol
LogP1.63
Rot. Bonds5

About 3-amino-N-(1-thiophen-3-ylpropan-2-yl)pyridine-2-sulfonamide

3-amino-N-(1-thiophen-3-ylpropan-2-yl)pyridine-2-sulfonamide (PubChem CID 103305478) has the molecular formula C12H15N3O2S2 and a molecular weight of 297.40 g/mol. Its IUPAC name is 3-amino-N-(1-thiophen-3-ylpropan-2-yl)pyridine-2-sulfonamide.

Molecular Properties

Compound Name3-amino-N-(1-thiophen-3-ylpropan-2-yl)pyridine-2-sulfonamide
PubChem CID103305478
Molecular FormulaC12H15N3O2S2
Molecular Weight297.40 g/mol
Exact Mass297.06
IUPAC Name3-amino-N-(1-thiophen-3-ylpropan-2-yl)pyridine-2-sulfonamide
SMILESCC(Cc1ccsc1)NS(=O)(=O)c1ncccc1N
InChIInChI=1S/C12H15N3O2S2/c1-9(7-10-4-6-18-8-10)15-19(16,17)12-11(13)3-2-5-14-12/h2-6,8-9,15H,7,13H2,1H3
InChIKeyXNXAKFJWSTUSMB-UHFFFAOYSA-N
XLogP1.63
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-amino-N-(4-methylpentan-2-yl)pyridine-2-sulfonamide
CID 103304535
2-(thiophen-3-ylmethylsulfonyl)pyridin-3-amine
CID 61369370
3-amino-N-propan-2-ylpyridine-2-sulfonamide
CID 103303655
2-amino-5-chloro-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide
CID 61474983
6-amino-5-chloro-N-(1-thiophen-3-ylpropan-2-yl)pyridine-3-sulfonamide
CID 64602655
2-(aminomethyl)-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide
CID 106053233
2-fluoro-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide
CID 47358916
5-amino-2-methyl-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide
CID 61474831
5-methyl-N-(1-thiophen-3-ylpropan-2-yl)-1H-pyrazole-4-sulfonamide
CID 54954014
4-amino-3-methoxy-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide
CID 81440427
2-(methylamino)-N-(1-thiophen-3-ylpropan-2-yl)benzenesulfonamide
CID 62152021
3-amino-1-ethyl-N-(1-thiophen-3-ylpropan-2-yl)pyrazole-4-sulfonamide
CID 61474909

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(1-thiophen-3-ylpropan-2-yl)pyridine-2-sulfonamide?
The IUPAC name of 3-amino-N-(1-thiophen-3-ylpropan-2-yl)pyridine-2-sulfonamide (CID 103305478) is 3-amino-N-(1-thiophen-3-ylpropan-2-yl)pyridine-2-sulfonamide.
What is the SMILES notation for 3-amino-N-(1-thiophen-3-ylpropan-2-yl)pyridine-2-sulfonamide?
The canonical SMILES for 3-amino-N-(1-thiophen-3-ylpropan-2-yl)pyridine-2-sulfonamide is CC(Cc1ccsc1)NS(=O)(=O)c1ncccc1N.
What is the InChIKey of 3-amino-N-(1-thiophen-3-ylpropan-2-yl)pyridine-2-sulfonamide?
The InChIKey is XNXAKFJWSTUSMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O2S2/c1-9(7-10-4-6-18-8-10)15-19(16,17)12-11(13)3-2-5-14-12/h2-6,8-9,15H,7,13H2,1H3.
What are the key properties of 3-amino-N-(1-thiophen-3-ylpropan-2-yl)pyridine-2-sulfonamide?
3-amino-N-(1-thiophen-3-ylpropan-2-yl)pyridine-2-sulfonamide has a molecular weight of 297.40 g/mol, XLogP of 1.63, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(1-thiophen-3-ylpropan-2-yl)pyridine-2-sulfonamide is sourced from PubChem (CID 103305478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).