N-ethyl-N-[methyl-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]sulfamoyl]ethanamine

C11H22N4O3S — CID 131919062

IUPACN-ethyl-N-[methyl-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]sulfamoyl]ethanamine
SMILESCCCc1noc(CN(C)S(=O)(=O)N(CC)CC)n1
InChIInChI=1S/C11H22N4O3S/c1-5-8-10-12-11(18-13-10)9-14(4)19(16,17)15(6-2)7-3/h5-9H2,1-4H3
InChIKeyWEVXYFIHBIQTHZ-UHFFFAOYSA-N
MW290.39 g/mol
LogP1.04
Rot. Bonds8

About N-ethyl-N-[methyl-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]sulfamoyl]ethanamine

N-ethyl-N-[methyl-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]sulfamoyl]ethanamine (PubChem CID 131919062) has the molecular formula C11H22N4O3S and a molecular weight of 290.39 g/mol. Its IUPAC name is N-ethyl-N-[methyl-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]sulfamoyl]ethanamine.

Molecular Properties

Compound NameN-ethyl-N-[methyl-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]sulfamoyl]ethanamine
PubChem CID131919062
Molecular FormulaC11H22N4O3S
Molecular Weight290.39 g/mol
Exact Mass290.14
IUPAC NameN-ethyl-N-[methyl-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]sulfamoyl]ethanamine
SMILESCCCc1noc(CN(C)S(=O)(=O)N(CC)CC)n1
InChIInChI=1S/C11H22N4O3S/c1-5-8-10-12-11(18-13-10)9-14(4)19(16,17)15(6-2)7-3/h5-9H2,1-4H3
InChIKeyWEVXYFIHBIQTHZ-UHFFFAOYSA-N
XLogP1.04
TPSA79.54 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.39
LogP ≤ 51.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[methyl-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]sulfamoyl]ethanamine?
The IUPAC name of N-ethyl-N-[methyl-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]sulfamoyl]ethanamine (CID 131919062) is N-ethyl-N-[methyl-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]sulfamoyl]ethanamine.
What is the SMILES notation for N-ethyl-N-[methyl-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]sulfamoyl]ethanamine?
The canonical SMILES for N-ethyl-N-[methyl-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]sulfamoyl]ethanamine is CCCc1noc(CN(C)S(=O)(=O)N(CC)CC)n1.
What is the InChIKey of N-ethyl-N-[methyl-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]sulfamoyl]ethanamine?
The InChIKey is WEVXYFIHBIQTHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N4O3S/c1-5-8-10-12-11(18-13-10)9-14(4)19(16,17)15(6-2)7-3/h5-9H2,1-4H3.
What are the key properties of N-ethyl-N-[methyl-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]sulfamoyl]ethanamine?
N-ethyl-N-[methyl-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]sulfamoyl]ethanamine has a molecular weight of 290.39 g/mol, XLogP of 1.04, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[methyl-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]sulfamoyl]ethanamine is sourced from PubChem (CID 131919062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).