4-[5-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1,3,4-oxadiazol-2-yl]-1-methylpyrrolidin-2-one

C14H18N4O3 — CID 136533794

IUPAC4-[5-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1,3,4-oxadiazol-2-yl]-1-methylpyrrolidin-2-one
SMILESCc1noc(C)c1CCc1nnc(C2CC(=O)N(C)C2)o1
InChIInChI=1S/C14H18N4O3/c1-8-11(9(2)21-17-8)4-5-12-15-16-14(20-12)10-6-13(19)18(3)7-10/h10H,4-7H2,1-3H3
InChIKeyLNPLHMPFGVXTLK-UHFFFAOYSA-N
MW290.32 g/mol
LogP1.41
Rot. Bonds4

About 4-[5-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1,3,4-oxadiazol-2-yl]-1-methylpyrrolidin-2-one

4-[5-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1,3,4-oxadiazol-2-yl]-1-methylpyrrolidin-2-one (PubChem CID 136533794) has the molecular formula C14H18N4O3 and a molecular weight of 290.32 g/mol. Its IUPAC name is 4-[5-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1,3,4-oxadiazol-2-yl]-1-methylpyrrolidin-2-one.

Molecular Properties

Compound Name4-[5-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1,3,4-oxadiazol-2-yl]-1-methylpyrrolidin-2-one
PubChem CID136533794
Molecular FormulaC14H18N4O3
Molecular Weight290.32 g/mol
Exact Mass290.14
IUPAC Name4-[5-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1,3,4-oxadiazol-2-yl]-1-methylpyrrolidin-2-one
SMILESCc1noc(C)c1CCc1nnc(C2CC(=O)N(C)C2)o1
InChIInChI=1S/C14H18N4O3/c1-8-11(9(2)21-17-8)4-5-12-15-16-14(20-12)10-6-13(19)18(3)7-10/h10H,4-7H2,1-3H3
InChIKeyLNPLHMPFGVXTLK-UHFFFAOYSA-N
XLogP1.41
TPSA85.26 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 51.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 4-[5-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1,3,4-oxadiazol-2-yl]-1-methylpyrrolidin-2-one 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

4-(5-amino-1,3,4-oxadiazol-2-yl)-1-methylpyrrolidin-2-one
CID 121207759
2-cyclopropyl-5-[[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]piperazin-1-yl]methyl]-1,3,4-oxadiazole
CID 56820809
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(1-methyl-5-oxopyrrolidin-3-yl)acetamide
CID 71789161
2-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-5-(1-methyltriazol-4-yl)-1,3,4-oxadiazole
CID 167902734
3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[(3S)-3-[5-(trifluoromethyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]propan-1-one
CID 97104476
3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(4R)-2-methyl-1,1-dioxo-3,4-dihydrothieno[2,3-e]thiazin-4-yl]propanamide
CID 99932392
(3aS,6aR)-3a-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3,4,6,6a-tetrahydro-1H-furo[3,4-c]pyrrole
CID 97474891
4-[1-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]piperidin-3-yl]-2-methyl-1H-pyrimidin-6-one
CID 171915775
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-1-methyl-2-oxopiperidine-4-carboxamide
CID 47864758
(4S)-1-cyclohexyl-4-[5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-1,2,4-oxadiazol-3-yl]pyrrolidin-2-one
CID 99746206
2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-[(3S)-1-methyl-5-oxopyrrolidin-3-yl]benzamide
CID 94800294
5-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-3-(1-methylpiperazin-2-yl)-1,2,4-oxadiazole;hydrochloride
CID 120956845

Frequently Asked Questions

What is the IUPAC name of 4-[5-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1,3,4-oxadiazol-2-yl]-1-methylpyrrolidin-2-one?
The IUPAC name of 4-[5-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1,3,4-oxadiazol-2-yl]-1-methylpyrrolidin-2-one (CID 136533794) is 4-[5-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1,3,4-oxadiazol-2-yl]-1-methylpyrrolidin-2-one.
What is the SMILES notation for 4-[5-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1,3,4-oxadiazol-2-yl]-1-methylpyrrolidin-2-one?
The canonical SMILES for 4-[5-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1,3,4-oxadiazol-2-yl]-1-methylpyrrolidin-2-one is Cc1noc(C)c1CCc1nnc(C2CC(=O)N(C)C2)o1.
What is the InChIKey of 4-[5-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1,3,4-oxadiazol-2-yl]-1-methylpyrrolidin-2-one?
The InChIKey is LNPLHMPFGVXTLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O3/c1-8-11(9(2)21-17-8)4-5-12-15-16-14(20-12)10-6-13(19)18(3)7-10/h10H,4-7H2,1-3H3.
What are the key properties of 4-[5-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1,3,4-oxadiazol-2-yl]-1-methylpyrrolidin-2-one?
4-[5-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1,3,4-oxadiazol-2-yl]-1-methylpyrrolidin-2-one has a molecular weight of 290.32 g/mol, XLogP of 1.41, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1,3,4-oxadiazol-2-yl]-1-methylpyrrolidin-2-one is sourced from PubChem (CID 136533794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).