N-ethyl-1-(5-methyl-1,3,4-thiadiazole-2-carbonyl)pyrrolidine-3-sulfonamide

C10H16N4O3S2 — CID 154738206

IUPACN-ethyl-1-(5-methyl-1,3,4-thiadiazole-2-carbonyl)pyrrolidine-3-sulfonamide
SMILESCCNS(=O)(=O)C1CCN(C(=O)c2nnc(C)s2)C1
InChIInChI=1S/C10H16N4O3S2/c1-3-11-19(16,17)8-4-5-14(6-8)10(15)9-13-12-7(2)18-9/h8,11H,3-6H2,1-2H3
InChIKeyYFSGZPGTGUMPBE-UHFFFAOYSA-N
MW304.40 g/mol
LogP0.00
Rot. Bonds4

About N-ethyl-1-(5-methyl-1,3,4-thiadiazole-2-carbonyl)pyrrolidine-3-sulfonamide

N-ethyl-1-(5-methyl-1,3,4-thiadiazole-2-carbonyl)pyrrolidine-3-sulfonamide (PubChem CID 154738206) has the molecular formula C10H16N4O3S2 and a molecular weight of 304.40 g/mol. Its IUPAC name is N-ethyl-1-(5-methyl-1,3,4-thiadiazole-2-carbonyl)pyrrolidine-3-sulfonamide.

Molecular Properties

Compound NameN-ethyl-1-(5-methyl-1,3,4-thiadiazole-2-carbonyl)pyrrolidine-3-sulfonamide
PubChem CID154738206
Molecular FormulaC10H16N4O3S2
Molecular Weight304.40 g/mol
Exact Mass304.07
IUPAC NameN-ethyl-1-(5-methyl-1,3,4-thiadiazole-2-carbonyl)pyrrolidine-3-sulfonamide
SMILESCCNS(=O)(=O)C1CCN(C(=O)c2nnc(C)s2)C1
InChIInChI=1S/C10H16N4O3S2/c1-3-11-19(16,17)8-4-5-14(6-8)10(15)9-13-12-7(2)18-9/h8,11H,3-6H2,1-2H3
InChIKeyYFSGZPGTGUMPBE-UHFFFAOYSA-N
XLogP0.00
TPSA92.26 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.40
LogP ≤ 50.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(5-methyl-1,3,4-thiadiazole-2-carbonyl)pyrrolidine-3-sulfonamide?
The IUPAC name of N-ethyl-1-(5-methyl-1,3,4-thiadiazole-2-carbonyl)pyrrolidine-3-sulfonamide (CID 154738206) is N-ethyl-1-(5-methyl-1,3,4-thiadiazole-2-carbonyl)pyrrolidine-3-sulfonamide.
What is the SMILES notation for N-ethyl-1-(5-methyl-1,3,4-thiadiazole-2-carbonyl)pyrrolidine-3-sulfonamide?
The canonical SMILES for N-ethyl-1-(5-methyl-1,3,4-thiadiazole-2-carbonyl)pyrrolidine-3-sulfonamide is CCNS(=O)(=O)C1CCN(C(=O)c2nnc(C)s2)C1.
What is the InChIKey of N-ethyl-1-(5-methyl-1,3,4-thiadiazole-2-carbonyl)pyrrolidine-3-sulfonamide?
The InChIKey is YFSGZPGTGUMPBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O3S2/c1-3-11-19(16,17)8-4-5-14(6-8)10(15)9-13-12-7(2)18-9/h8,11H,3-6H2,1-2H3.
What are the key properties of N-ethyl-1-(5-methyl-1,3,4-thiadiazole-2-carbonyl)pyrrolidine-3-sulfonamide?
N-ethyl-1-(5-methyl-1,3,4-thiadiazole-2-carbonyl)pyrrolidine-3-sulfonamide has a molecular weight of 304.40 g/mol, XLogP of 0.00, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(5-methyl-1,3,4-thiadiazole-2-carbonyl)pyrrolidine-3-sulfonamide is sourced from PubChem (CID 154738206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).