5-(ethylaminomethyl)-N-pyridin-2-ylfuran-2-sulfonamide

C12H15N3O3S — CID 106082609

IUPAC5-(ethylaminomethyl)-N-pyridin-2-ylfuran-2-sulfonamide
SMILESCCNCc1ccc(S(=O)(=O)Nc2ccccn2)o1
InChIInChI=1S/C12H15N3O3S/c1-2-13-9-10-6-7-12(18-10)19(16,17)15-11-5-3-4-8-14-11/h3-8,13H,2,9H2,1H3,(H,14,15)
InChIKeyAGVFLYWCMPSDEM-UHFFFAOYSA-N
MW281.34 g/mol
LogP1.58
Rot. Bonds6

About 5-(ethylaminomethyl)-N-pyridin-2-ylfuran-2-sulfonamide

5-(ethylaminomethyl)-N-pyridin-2-ylfuran-2-sulfonamide (PubChem CID 106082609) has the molecular formula C12H15N3O3S and a molecular weight of 281.34 g/mol. Its IUPAC name is 5-(ethylaminomethyl)-N-pyridin-2-ylfuran-2-sulfonamide.

Molecular Properties

Compound Name5-(ethylaminomethyl)-N-pyridin-2-ylfuran-2-sulfonamide
PubChem CID106082609
Molecular FormulaC12H15N3O3S
Molecular Weight281.34 g/mol
Exact Mass281.08
IUPAC Name5-(ethylaminomethyl)-N-pyridin-2-ylfuran-2-sulfonamide
SMILESCCNCc1ccc(S(=O)(=O)Nc2ccccn2)o1
InChIInChI=1S/C12H15N3O3S/c1-2-13-9-10-6-7-12(18-10)19(16,17)15-11-5-3-4-8-14-11/h3-8,13H,2,9H2,1H3,(H,14,15)
InChIKeyAGVFLYWCMPSDEM-UHFFFAOYSA-N
XLogP1.58
TPSA84.23 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.34
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(ethylaminomethyl)-N-(6-methyl-2-pyridinyl)furan-2-sulfonamide
CID 106086991
5-(ethylaminomethyl)-N-(1,3-thiazol-2-yl)furan-2-sulfonamide
CID 106031932
5-(ethylaminomethyl)-N-(2-methoxyphenyl)furan-2-sulfonamide
CID 106045113
5-(pyridin-2-ylsulfamoyl)furan-2-carboxylic acid
CID 1322341
5-(ethylaminomethyl)-N-(1,2-oxazol-5-ylmethyl)furan-2-sulfonamide
CID 106423367
5-(ethylaminomethyl)-N-(3-iodophenyl)furan-2-sulfonamide
CID 106029546
5-(ethylaminomethyl)-N-(4-hydroxybutyl)furan-2-sulfonamide
CID 106846834
N-(3-bromo-2-methylphenyl)-5-(ethylaminomethyl)furan-2-sulfonamide
CID 106088206
4-propyl-N-pyridin-2-ylbenzenesulfonamide
CID 3269642
5-(ethylaminomethyl)-N-(3-methylpentan-3-yl)furan-2-sulfonamide
CID 106331722
5-(ethylaminomethyl)-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]furan-2-sulfonamide
CID 106410018
2-(ethylamino)-N-pyridin-2-ylpyrimidine-5-sulfonamide
CID 62149006

Frequently Asked Questions

What is the IUPAC name of 5-(ethylaminomethyl)-N-pyridin-2-ylfuran-2-sulfonamide?
The IUPAC name of 5-(ethylaminomethyl)-N-pyridin-2-ylfuran-2-sulfonamide (CID 106082609) is 5-(ethylaminomethyl)-N-pyridin-2-ylfuran-2-sulfonamide.
What is the SMILES notation for 5-(ethylaminomethyl)-N-pyridin-2-ylfuran-2-sulfonamide?
The canonical SMILES for 5-(ethylaminomethyl)-N-pyridin-2-ylfuran-2-sulfonamide is CCNCc1ccc(S(=O)(=O)Nc2ccccn2)o1.
What is the InChIKey of 5-(ethylaminomethyl)-N-pyridin-2-ylfuran-2-sulfonamide?
The InChIKey is AGVFLYWCMPSDEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O3S/c1-2-13-9-10-6-7-12(18-10)19(16,17)15-11-5-3-4-8-14-11/h3-8,13H,2,9H2,1H3,(H,14,15).
What are the key properties of 5-(ethylaminomethyl)-N-pyridin-2-ylfuran-2-sulfonamide?
5-(ethylaminomethyl)-N-pyridin-2-ylfuran-2-sulfonamide has a molecular weight of 281.34 g/mol, XLogP of 1.58, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(ethylaminomethyl)-N-pyridin-2-ylfuran-2-sulfonamide is sourced from PubChem (CID 106082609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).