3-(ethylamino)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyridine-2-sulfonamide

C11H15N5O3S — CID 106407708

IUPAC3-(ethylamino)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyridine-2-sulfonamide
SMILESCCNc1cccnc1S(=O)(=O)NCc1noc(C)n1
InChIInChI=1S/C11H15N5O3S/c1-3-12-9-5-4-6-13-11(9)20(17,18)14-7-10-15-8(2)19-16-10/h4-6,12,14H,3,7H2,1-2H3
InChIKeyWSAXNPFXLYOYGC-UHFFFAOYSA-N
MW297.34 g/mol
LogP0.68
Rot. Bonds6

About 3-(ethylamino)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyridine-2-sulfonamide

3-(ethylamino)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyridine-2-sulfonamide (PubChem CID 106407708) has the molecular formula C11H15N5O3S and a molecular weight of 297.34 g/mol. Its IUPAC name is 3-(ethylamino)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyridine-2-sulfonamide.

Molecular Properties

Compound Name3-(ethylamino)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyridine-2-sulfonamide
PubChem CID106407708
Molecular FormulaC11H15N5O3S
Molecular Weight297.34 g/mol
Exact Mass297.09
IUPAC Name3-(ethylamino)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyridine-2-sulfonamide
SMILESCCNc1cccnc1S(=O)(=O)NCc1noc(C)n1
InChIInChI=1S/C11H15N5O3S/c1-3-12-9-5-4-6-13-11(9)20(17,18)14-7-10-15-8(2)19-16-10/h4-6,12,14H,3,7H2,1-2H3
InChIKeyWSAXNPFXLYOYGC-UHFFFAOYSA-N
XLogP0.68
TPSA110.01 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.34
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

N-methyl-N-[(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)methyl]benzenesulfonamide
CID 1861514
N-pyridin-3-yl-4-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]benzenesulfonamide
CID 71230839
2-[[1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]amino]-N-pyridin-3-ylacetamide
CID 56802405
N-[2-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)propan-2-yl]methanesulfonamide
CID 71975505
"N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]-3-pyridinesulfonamide"
CID 91907156
3-(pyrazin-2-yl)-N-(4-sulfamoylphenyl)-1,2,4-oxadiazole-5-carboxamide
CID 49676426
3-Methyl-5-(1-(pyridin-3-ylsulfonyl)azetidin-3-yl)-1,2,4-oxadiazole
CID 49744676
N-((3-methyl-1,2,4-oxadiazol-5-yl)methyl)-1-(pyridin-3-ylsulfonyl)piperidine-4-carboxamide
CID 56724154
5-Tert-butyl-3-[(4-pyridin-3-ylsulfonylpiperazin-1-yl)methyl]-1,2,4-oxadiazole
CID 45914368
N-cyclopropyl-N-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl]pyridine-3-sulfonamide
CID 53531616
N-{[3-(Methoxymethyl)-1,2,4-oxadiazol-5-YL]methyl}pyridine-3-sulfonamide
CID 122565765
N-[(1S)-1-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)ethyl]butane-1-sulfonamide
CID 164643334

Frequently Asked Questions

What is the IUPAC name of 3-(ethylamino)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyridine-2-sulfonamide?
The IUPAC name of 3-(ethylamino)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyridine-2-sulfonamide (CID 106407708) is 3-(ethylamino)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyridine-2-sulfonamide.
What is the SMILES notation for 3-(ethylamino)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyridine-2-sulfonamide?
The canonical SMILES for 3-(ethylamino)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyridine-2-sulfonamide is CCNc1cccnc1S(=O)(=O)NCc1noc(C)n1.
What is the InChIKey of 3-(ethylamino)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyridine-2-sulfonamide?
The InChIKey is WSAXNPFXLYOYGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O3S/c1-3-12-9-5-4-6-13-11(9)20(17,18)14-7-10-15-8(2)19-16-10/h4-6,12,14H,3,7H2,1-2H3.
What are the key properties of 3-(ethylamino)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyridine-2-sulfonamide?
3-(ethylamino)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyridine-2-sulfonamide has a molecular weight of 297.34 g/mol, XLogP of 0.68, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylamino)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]pyridine-2-sulfonamide is sourced from PubChem (CID 106407708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).