6-amino-N-cyclopropyl-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide

C13H15N3O2S2 — CID 62158435

IUPAC6-amino-N-cyclopropyl-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide
SMILESNc1ccc(S(=O)(=O)N(Cc2ccsc2)C2CC2)cn1
InChIInChI=1S/C13H15N3O2S2/c14-13-4-3-12(7-15-13)20(17,18)16(11-1-2-11)8-10-5-6-19-9-10/h3-7,9,11H,1-2,8H2,(H2,14,15)
InChIKeyMRDCOAMXGFROSY-UHFFFAOYSA-N
MW309.42 g/mol
LogP2.08
Rot. Bonds5

About 6-amino-N-cyclopropyl-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide

6-amino-N-cyclopropyl-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide (PubChem CID 62158435) has the molecular formula C13H15N3O2S2 and a molecular weight of 309.42 g/mol. Its IUPAC name is 6-amino-N-cyclopropyl-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-amino-N-cyclopropyl-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide
PubChem CID62158435
Molecular FormulaC13H15N3O2S2
Molecular Weight309.42 g/mol
Exact Mass309.06
IUPAC Name6-amino-N-cyclopropyl-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide
SMILESNc1ccc(S(=O)(=O)N(Cc2ccsc2)C2CC2)cn1
InChIInChI=1S/C13H15N3O2S2/c14-13-4-3-12(7-15-13)20(17,18)16(11-1-2-11)8-10-5-6-19-9-10/h3-7,9,11H,1-2,8H2,(H2,14,15)
InChIKeyMRDCOAMXGFROSY-UHFFFAOYSA-N
XLogP2.08
TPSA76.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.42
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-[cyclopropyl(thiophen-3-ylmethyl)sulfamoyl]phenyl]acetamide
CID 47082304
2-amino-4-bromo-N-cyclopropyl-N-(thiophen-3-ylmethyl)benzenesulfonamide
CID 61433555
2-amino-N-cyclopropyl-4-methyl-N-(thiophen-3-ylmethyl)benzenesulfonamide
CID 61433464
6-amino-N-butyl-N-cyclopropylpyridine-3-sulfonamide
CID 62157833
3-bromo-N-cyclopropyl-N-(thiophen-3-ylmethyl)thiophene-2-sulfonamide
CID 61456293
5-[cyclopropyl(thiophen-3-ylmethyl)sulfamoyl]thiophene-2-carboxylic acid
CID 61167567
N-cyclopropyl-2-methyl-5-nitro-N-(thiophen-3-ylmethyl)benzenesulfonamide
CID 51055462
2-N-cyclopropyl-4-methyl-2-N-(thiophen-3-ylmethyl)pyridine-2,5-diamine
CID 79173041
N-cyclopropyl-1-[(3R)-oxolan-3-yl]-N-(thiophen-3-ylmethyl)methanesulfonamide
CID 95317371
4-amino-N-cyclopropyl-6-methyl-N-(thiophen-3-ylmethyl)pyridine-3-carboxamide
CID 81240954
(2R,5S)-N-cyclopropyl-2,5-dimethyl-N-(thiophen-3-ylmethyl)morpholine-4-sulfonamide
CID 98775245
2-chloro-N-methyl-N-(thiophen-3-ylmethyl)pyrimidine-5-sulfonamide
CID 43528240

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-cyclopropyl-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide?
The IUPAC name of 6-amino-N-cyclopropyl-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide (CID 62158435) is 6-amino-N-cyclopropyl-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide.
What is the SMILES notation for 6-amino-N-cyclopropyl-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide?
The canonical SMILES for 6-amino-N-cyclopropyl-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide is Nc1ccc(S(=O)(=O)N(Cc2ccsc2)C2CC2)cn1.
What is the InChIKey of 6-amino-N-cyclopropyl-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide?
The InChIKey is MRDCOAMXGFROSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2S2/c14-13-4-3-12(7-15-13)20(17,18)16(11-1-2-11)8-10-5-6-19-9-10/h3-7,9,11H,1-2,8H2,(H2,14,15).
What are the key properties of 6-amino-N-cyclopropyl-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide?
6-amino-N-cyclopropyl-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide has a molecular weight of 309.42 g/mol, XLogP of 2.08, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-cyclopropyl-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide is sourced from PubChem (CID 62158435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).