2-(methylamino)-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide

C11H13N3O2S2 — CID 63247729

IUPAC2-(methylamino)-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide
SMILESCNc1ncccc1S(=O)(=O)NCc1ccsc1
InChIInChI=1S/C11H13N3O2S2/c1-12-11-10(3-2-5-13-11)18(15,16)14-7-9-4-6-17-8-9/h2-6,8,14H,7H2,1H3,(H,12,13)
InChIKeyRVKMXQQBPJQTCY-UHFFFAOYSA-N
MW283.38 g/mol
LogP1.66
Rot. Bonds5

About 2-(methylamino)-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide

2-(methylamino)-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide (PubChem CID 63247729) has the molecular formula C11H13N3O2S2 and a molecular weight of 283.38 g/mol. Its IUPAC name is 2-(methylamino)-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-(methylamino)-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide
PubChem CID63247729
Molecular FormulaC11H13N3O2S2
Molecular Weight283.38 g/mol
Exact Mass283.04
IUPAC Name2-(methylamino)-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide
SMILESCNc1ncccc1S(=O)(=O)NCc1ccsc1
InChIInChI=1S/C11H13N3O2S2/c1-12-11-10(3-2-5-13-11)18(15,16)14-7-9-4-6-17-8-9/h2-6,8,14H,7H2,1H3,(H,12,13)
InChIKeyRVKMXQQBPJQTCY-UHFFFAOYSA-N
XLogP1.66
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.38
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide
CID 55174098
N-[(4-ethylphenyl)methyl]-2-(methylamino)pyridine-3-sulfonamide
CID 106900712
N-[(4-chlorophenyl)methyl]-2-(methylamino)pyridine-3-sulfonamide
CID 62164717
2-(methylamino)-N-[(3-methylphenyl)methyl]pyridine-3-sulfonamide
CID 62146869
2-(methylamino)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridine-3-sulfonamide
CID 62156810
2-(methylamino)-N-(2,2,2-trifluoroethyl)pyridine-3-sulfonamide
CID 62149939
3-chloro-2-methyl-N-(thiophen-3-ylmethyl)benzenesulfonamide
CID 21110297
N-(cyclopentylmethyl)-2-(methylamino)pyridine-3-sulfonamide
CID 62145518
2-hydrazinyl-N-(thiophen-3-ylmethyl)benzenesulfonamide
CID 63244355
2-(methylamino)-N-(2-methyl-2-thiophen-2-ylpropyl)pyridine-3-sulfonamide
CID 80524392
2-(methylamino)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyridine-3-sulfonamide
CID 79356890
2-chloro-N-(2-thiophen-3-ylethyl)pyridine-3-sulfonamide
CID 54953527

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide?
The IUPAC name of 2-(methylamino)-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide (CID 63247729) is 2-(methylamino)-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide.
What is the SMILES notation for 2-(methylamino)-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide?
The canonical SMILES for 2-(methylamino)-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide is CNc1ncccc1S(=O)(=O)NCc1ccsc1.
What is the InChIKey of 2-(methylamino)-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide?
The InChIKey is RVKMXQQBPJQTCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O2S2/c1-12-11-10(3-2-5-13-11)18(15,16)14-7-9-4-6-17-8-9/h2-6,8,14H,7H2,1H3,(H,12,13).
What are the key properties of 2-(methylamino)-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide?
2-(methylamino)-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide has a molecular weight of 283.38 g/mol, XLogP of 1.66, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide is sourced from PubChem (CID 63247729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).