N-(methylsulfamoyl)-1-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methanamine

C8H10N4O3S2 — CID 110632114

IUPACN-(methylsulfamoyl)-1-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methanamine
SMILESCNS(=O)(=O)NCc1nc(-c2cccs2)no1
InChIInChI=1S/C8H10N4O3S2/c1-9-17(13,14)10-5-7-11-8(12-15-7)6-3-2-4-16-6/h2-4,9-10H,5H2,1H3
InChIKeyHLDSYODLJLPWKA-UHFFFAOYSA-N
MW274.33 g/mol
LogP0.35
Rot. Bonds5

About N-(methylsulfamoyl)-1-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methanamine

N-(methylsulfamoyl)-1-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methanamine (PubChem CID 110632114) has the molecular formula C8H10N4O3S2 and a molecular weight of 274.33 g/mol. Its IUPAC name is N-(methylsulfamoyl)-1-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methanamine.

Molecular Properties

Compound NameN-(methylsulfamoyl)-1-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methanamine
PubChem CID110632114
Molecular FormulaC8H10N4O3S2
Molecular Weight274.33 g/mol
Exact Mass274.02
IUPAC NameN-(methylsulfamoyl)-1-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methanamine
SMILESCNS(=O)(=O)NCc1nc(-c2cccs2)no1
InChIInChI=1S/C8H10N4O3S2/c1-9-17(13,14)10-5-7-11-8(12-15-7)6-3-2-4-16-6/h2-4,9-10H,5H2,1H3
InChIKeyHLDSYODLJLPWKA-UHFFFAOYSA-N
XLogP0.35
TPSA97.12 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.33
LogP ≤ 50.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[2-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)ethyl]ethanesulfonamide
CID 110323231
4-nitro-N-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]benzenesulfonamide
CID 92801370
3-methylsulfonyl-N-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]aniline
CID 17452778
(2R)-N-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]butan-2-amine
CID 27261231
5-[2-(dimethylsulfamoylamino)ethyl]-3-thiophen-2-yl-1,2,4-oxadiazole
CID 110323234
3-(benzenesulfonyl)-N-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]propanamide
CID 110310602
N-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]-1,3-benzodioxole-5-sulfonamide
CID 110293472
4-(cyclopropanecarbonyl)-N-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]benzenesulfonamide
CID 110632113
5-(2-chloroprop-2-enylsulfonylmethyl)-3-thiophen-2-yl-1,2,4-oxadiazole
CID 47024366
N-methyl-N-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]thiophene-2-sulfonamide
CID 53277887
4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)butanal
CID 130369057
2-(dimethylamino)-2-phenyl-N-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]acetamide
CID 110632070

Frequently Asked Questions

What is the IUPAC name of N-(methylsulfamoyl)-1-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methanamine?
The IUPAC name of N-(methylsulfamoyl)-1-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methanamine (CID 110632114) is N-(methylsulfamoyl)-1-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methanamine.
What is the SMILES notation for N-(methylsulfamoyl)-1-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methanamine?
The canonical SMILES for N-(methylsulfamoyl)-1-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methanamine is CNS(=O)(=O)NCc1nc(-c2cccs2)no1.
What is the InChIKey of N-(methylsulfamoyl)-1-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methanamine?
The InChIKey is HLDSYODLJLPWKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4O3S2/c1-9-17(13,14)10-5-7-11-8(12-15-7)6-3-2-4-16-6/h2-4,9-10H,5H2,1H3.
What are the key properties of N-(methylsulfamoyl)-1-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methanamine?
N-(methylsulfamoyl)-1-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methanamine has a molecular weight of 274.33 g/mol, XLogP of 0.35, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(methylsulfamoyl)-1-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methanamine is sourced from PubChem (CID 110632114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).