1-(5-ethyl-1,3,4-thiadiazol-2-yl)-N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-5-oxopyrrolidine-3-carboxamide

C14H18N6O3S — CID 155498733

IUPAC1-(5-ethyl-1,3,4-thiadiazol-2-yl)-N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-5-oxopyrrolidine-3-carboxamide
SMILESCCc1nnc(N2CC(C(=O)N(C)CCc3ncon3)CC2=O)s1
InChIInChI=1S/C14H18N6O3S/c1-3-11-16-17-14(24-11)20-7-9(6-12(20)21)13(22)19(2)5-4-10-15-8-23-18-10/h8-9H,3-7H2,1-2H3
InChIKeyWWINCUYVXNEAQU-UHFFFAOYSA-N
MW350.40 g/mol
LogP0.54
Rot. Bonds6

About 1-(5-ethyl-1,3,4-thiadiazol-2-yl)-N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-5-oxopyrrolidine-3-carboxamide

1-(5-ethyl-1,3,4-thiadiazol-2-yl)-N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-5-oxopyrrolidine-3-carboxamide (PubChem CID 155498733) has the molecular formula C14H18N6O3S and a molecular weight of 350.40 g/mol. Its IUPAC name is 1-(5-ethyl-1,3,4-thiadiazol-2-yl)-N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound Name1-(5-ethyl-1,3,4-thiadiazol-2-yl)-N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-5-oxopyrrolidine-3-carboxamide
PubChem CID155498733
Molecular FormulaC14H18N6O3S
Molecular Weight350.40 g/mol
Exact Mass350.12
IUPAC Name1-(5-ethyl-1,3,4-thiadiazol-2-yl)-N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-5-oxopyrrolidine-3-carboxamide
SMILESCCc1nnc(N2CC(C(=O)N(C)CCc3ncon3)CC2=O)s1
InChIInChI=1S/C14H18N6O3S/c1-3-11-16-17-14(24-11)20-7-9(6-12(20)21)13(22)19(2)5-4-10-15-8-23-18-10/h8-9H,3-7H2,1-2H3
InChIKeyWWINCUYVXNEAQU-UHFFFAOYSA-N
XLogP0.54
TPSA105.32 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.40
LogP ≤ 50.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 1-(5-ethyl-1,3,4-thiadiazol-2-yl)-N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-5-oxopyrrolidine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(5-ethyl-1,3,4-thiadiazol-2-yl)-N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of 1-(5-ethyl-1,3,4-thiadiazol-2-yl)-N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-5-oxopyrrolidine-3-carboxamide (CID 155498733) is 1-(5-ethyl-1,3,4-thiadiazol-2-yl)-N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for 1-(5-ethyl-1,3,4-thiadiazol-2-yl)-N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for 1-(5-ethyl-1,3,4-thiadiazol-2-yl)-N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-5-oxopyrrolidine-3-carboxamide is CCc1nnc(N2CC(C(=O)N(C)CCc3ncon3)CC2=O)s1.
What is the InChIKey of 1-(5-ethyl-1,3,4-thiadiazol-2-yl)-N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-5-oxopyrrolidine-3-carboxamide?
The InChIKey is WWINCUYVXNEAQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N6O3S/c1-3-11-16-17-14(24-11)20-7-9(6-12(20)21)13(22)19(2)5-4-10-15-8-23-18-10/h8-9H,3-7H2,1-2H3.
What are the key properties of 1-(5-ethyl-1,3,4-thiadiazol-2-yl)-N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-5-oxopyrrolidine-3-carboxamide?
1-(5-ethyl-1,3,4-thiadiazol-2-yl)-N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-5-oxopyrrolidine-3-carboxamide has a molecular weight of 350.40 g/mol, XLogP of 0.54, 6 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-ethyl-1,3,4-thiadiazol-2-yl)-N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 155498733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).