5-(methylaminomethyl)-N-(1,3-thiazol-2-yl)pyridine-2-sulfonamide

C10H12N4O2S2 — CID 114138839

IUPAC5-(methylaminomethyl)-N-(1,3-thiazol-2-yl)pyridine-2-sulfonamide
SMILESCNCc1ccc(S(=O)(=O)Nc2nccs2)nc1
InChIInChI=1S/C10H12N4O2S2/c1-11-6-8-2-3-9(13-7-8)18(15,16)14-10-12-4-5-17-10/h2-5,7,11H,6H2,1H3,(H,12,14)
InChIKeySSFCKQDERUXGRO-UHFFFAOYSA-N
MW284.37 g/mol
LogP1.06
Rot. Bonds5

About 5-(methylaminomethyl)-N-(1,3-thiazol-2-yl)pyridine-2-sulfonamide

5-(methylaminomethyl)-N-(1,3-thiazol-2-yl)pyridine-2-sulfonamide (PubChem CID 114138839) has the molecular formula C10H12N4O2S2 and a molecular weight of 284.37 g/mol. Its IUPAC name is 5-(methylaminomethyl)-N-(1,3-thiazol-2-yl)pyridine-2-sulfonamide.

Molecular Properties

Compound Name5-(methylaminomethyl)-N-(1,3-thiazol-2-yl)pyridine-2-sulfonamide
PubChem CID114138839
Molecular FormulaC10H12N4O2S2
Molecular Weight284.37 g/mol
Exact Mass284.04
IUPAC Name5-(methylaminomethyl)-N-(1,3-thiazol-2-yl)pyridine-2-sulfonamide
SMILESCNCc1ccc(S(=O)(=O)Nc2nccs2)nc1
InChIInChI=1S/C10H12N4O2S2/c1-11-6-8-2-3-9(13-7-8)18(15,16)14-10-12-4-5-17-10/h2-5,7,11H,6H2,1H3,(H,12,14)
InChIKeySSFCKQDERUXGRO-UHFFFAOYSA-N
XLogP1.06
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.37
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5-[(propan-2-ylamino)methyl]-N-(1,3-thiazol-2-yl)pyridine-2-sulfonamide
CID 106031744
2-methyl-3-(methylaminomethyl)-N-(1,3-thiazol-2-yl)benzenesulfonamide
CID 106031858
N-(2-chloro-5-methylphenyl)-5-(methylaminomethyl)pyridine-2-sulfonamide
CID 106087639
N-cyclooctyl-5-(methylaminomethyl)pyridine-2-sulfonamide
CID 106058846
N-(3,3-dimethylbutyl)-5-(methylaminomethyl)pyridine-2-sulfonamide
CID 106085622
N-(3,3-dimethylbutan-2-yl)-5-(methylaminomethyl)pyridine-2-sulfonamide
CID 106079204
5-(methylaminomethyl)-N-(pyridazin-3-ylmethyl)pyridine-2-sulfonamide
CID 106089544
4-(2-chloroethyl)-N-(1,3-thiazol-2-yl)benzenesulfonamide
CID 28719509
5-(methylaminomethyl)-N-(2-propan-2-yloxyethyl)pyridine-2-sulfonamide
CID 106077591
N-(cyclopentylmethyl)-5-(methylaminomethyl)pyridine-2-sulfonamide
CID 106027073
5-[(cyclopropylamino)methyl]-N-(1,3,4-thiadiazol-2-yl)pyridine-2-sulfonamide
CID 106081360
5-(methylaminomethyl)-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-2-sulfonamide
CID 106050373

Frequently Asked Questions

What is the IUPAC name of 5-(methylaminomethyl)-N-(1,3-thiazol-2-yl)pyridine-2-sulfonamide?
The IUPAC name of 5-(methylaminomethyl)-N-(1,3-thiazol-2-yl)pyridine-2-sulfonamide (CID 114138839) is 5-(methylaminomethyl)-N-(1,3-thiazol-2-yl)pyridine-2-sulfonamide.
What is the SMILES notation for 5-(methylaminomethyl)-N-(1,3-thiazol-2-yl)pyridine-2-sulfonamide?
The canonical SMILES for 5-(methylaminomethyl)-N-(1,3-thiazol-2-yl)pyridine-2-sulfonamide is CNCc1ccc(S(=O)(=O)Nc2nccs2)nc1.
What is the InChIKey of 5-(methylaminomethyl)-N-(1,3-thiazol-2-yl)pyridine-2-sulfonamide?
The InChIKey is SSFCKQDERUXGRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O2S2/c1-11-6-8-2-3-9(13-7-8)18(15,16)14-10-12-4-5-17-10/h2-5,7,11H,6H2,1H3,(H,12,14).
What are the key properties of 5-(methylaminomethyl)-N-(1,3-thiazol-2-yl)pyridine-2-sulfonamide?
5-(methylaminomethyl)-N-(1,3-thiazol-2-yl)pyridine-2-sulfonamide has a molecular weight of 284.37 g/mol, XLogP of 1.06, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methylaminomethyl)-N-(1,3-thiazol-2-yl)pyridine-2-sulfonamide is sourced from PubChem (CID 114138839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).