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

C15H22N4O3S — CID 154820579

IUPAC1-(5-ethyl-1,3,4-thiadiazol-2-yl)-N-methyl-N-[(3-methyloxetan-3-yl)methyl]-5-oxopyrrolidine-3-carboxamide
SMILESCCc1nnc(N2CC(C(=O)N(C)CC3(C)COC3)CC2=O)s1
InChIInChI=1S/C15H22N4O3S/c1-4-11-16-17-14(23-11)19-6-10(5-12(19)20)13(21)18(3)7-15(2)8-22-9-15/h10H,4-9H2,1-3H3
InChIKeyQBKUHOXRKSAOMZ-UHFFFAOYSA-N
MW338.43 g/mol
LogP0.95
Rot. Bonds5

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

1-(5-ethyl-1,3,4-thiadiazol-2-yl)-N-methyl-N-[(3-methyloxetan-3-yl)methyl]-5-oxopyrrolidine-3-carboxamide (PubChem CID 154820579) has the molecular formula C15H22N4O3S and a molecular weight of 338.43 g/mol. Its IUPAC name is 1-(5-ethyl-1,3,4-thiadiazol-2-yl)-N-methyl-N-[(3-methyloxetan-3-yl)methyl]-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound Name1-(5-ethyl-1,3,4-thiadiazol-2-yl)-N-methyl-N-[(3-methyloxetan-3-yl)methyl]-5-oxopyrrolidine-3-carboxamide
PubChem CID154820579
Molecular FormulaC15H22N4O3S
Molecular Weight338.43 g/mol
Exact Mass338.14
IUPAC Name1-(5-ethyl-1,3,4-thiadiazol-2-yl)-N-methyl-N-[(3-methyloxetan-3-yl)methyl]-5-oxopyrrolidine-3-carboxamide
SMILESCCc1nnc(N2CC(C(=O)N(C)CC3(C)COC3)CC2=O)s1
InChIInChI=1S/C15H22N4O3S/c1-4-11-16-17-14(23-11)19-6-10(5-12(19)20)13(21)18(3)7-15(2)8-22-9-15/h10H,4-9H2,1-3H3
InChIKeyQBKUHOXRKSAOMZ-UHFFFAOYSA-N
XLogP0.95
TPSA75.63 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.43
LogP ≤ 50.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 1-(5-ethyl-1,3,4-thiadiazol-2-yl)-N-methyl-N-[(3-methyloxetan-3-yl)methyl]-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

Related Compounds

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
N-[2-(2-ethylphenoxy)ethyl]-1-(5-ethyl-1,3,4-thiadiazol-2-yl)-N-methyl-5-oxopyrrolidine-3-carboxamide
CID 154819737
N-[[1-[ethyl(methyl)amino]cyclohexyl]methyl]-1-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-oxopyrrolidine-3-carboxamide
CID 155491366
1-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-(hydroxymethyl)pyrrolidin-2-one
CID 168662204
N-(2-methoxyethyl)-N-methyl-1-(5-methyl-1,3,4-thiadiazol-2-yl)-5-oxopyrrolidine-3-carboxamide
CID 154566425
4-(4-azatricyclo[4.3.1.13,8]undecane-4-carbonyl)-1-(5-ethyl-1,3,4-thiadiazol-2-yl)pyrrolidin-2-one
CID 154564819
1-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-5-oxopyrrolidine-3-carboxylic acid
CID 168690491
methyl 1-(5-butyl-1,3,4-thiadiazol-2-yl)-5-oxopyrrolidine-3-carboxylate
CID 168693081
N-[[1-(4-chlorophenyl)cyclopropyl]methyl]-1-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-oxopyrrolidine-3-carboxamide
CID 155915672
1-cyclohexyl-4-[1-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-oxopyrrolidine-3-carbonyl]piperazin-2-one
CID 154564044
formic acid;1-[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]-N-methyl-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]-5-oxopyrrolidine-3-carboxamide
CID 163333990
1-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-[3-(2-methylphenoxy)azetidine-1-carbonyl]pyrrolidin-2-one
CID 155492947

Frequently Asked Questions

What is the IUPAC name of 1-(5-ethyl-1,3,4-thiadiazol-2-yl)-N-methyl-N-[(3-methyloxetan-3-yl)methyl]-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of 1-(5-ethyl-1,3,4-thiadiazol-2-yl)-N-methyl-N-[(3-methyloxetan-3-yl)methyl]-5-oxopyrrolidine-3-carboxamide (CID 154820579) is 1-(5-ethyl-1,3,4-thiadiazol-2-yl)-N-methyl-N-[(3-methyloxetan-3-yl)methyl]-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for 1-(5-ethyl-1,3,4-thiadiazol-2-yl)-N-methyl-N-[(3-methyloxetan-3-yl)methyl]-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for 1-(5-ethyl-1,3,4-thiadiazol-2-yl)-N-methyl-N-[(3-methyloxetan-3-yl)methyl]-5-oxopyrrolidine-3-carboxamide is CCc1nnc(N2CC(C(=O)N(C)CC3(C)COC3)CC2=O)s1.
What is the InChIKey of 1-(5-ethyl-1,3,4-thiadiazol-2-yl)-N-methyl-N-[(3-methyloxetan-3-yl)methyl]-5-oxopyrrolidine-3-carboxamide?
The InChIKey is QBKUHOXRKSAOMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O3S/c1-4-11-16-17-14(23-11)19-6-10(5-12(19)20)13(21)18(3)7-15(2)8-22-9-15/h10H,4-9H2,1-3H3.
What are the key properties of 1-(5-ethyl-1,3,4-thiadiazol-2-yl)-N-methyl-N-[(3-methyloxetan-3-yl)methyl]-5-oxopyrrolidine-3-carboxamide?
1-(5-ethyl-1,3,4-thiadiazol-2-yl)-N-methyl-N-[(3-methyloxetan-3-yl)methyl]-5-oxopyrrolidine-3-carboxamide has a molecular weight of 338.43 g/mol, XLogP of 0.95, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-ethyl-1,3,4-thiadiazol-2-yl)-N-methyl-N-[(3-methyloxetan-3-yl)methyl]-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 154820579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).