1-methyl-N-[2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)ethyl]pyrrolidine-2-carboxamide

C10H16N4O3 — CID 137202849

IUPAC1-methyl-N-[2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)ethyl]pyrrolidine-2-carboxamide
SMILESCN1CCCC1C(=O)NCCc1noc(=O)[nH]1
InChIInChI=1S/C10H16N4O3/c1-14-6-2-3-7(14)9(15)11-5-4-8-12-10(16)17-13-8/h7H,2-6H2,1H3,(H,11,15)(H,12,13,16)
InChIKeyVDWBKZBUDZYMDO-UHFFFAOYSA-N
MW240.26 g/mol
LogP-0.88
Rot. Bonds4

About 1-methyl-N-[2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)ethyl]pyrrolidine-2-carboxamide

1-methyl-N-[2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)ethyl]pyrrolidine-2-carboxamide (PubChem CID 137202849) has the molecular formula C10H16N4O3 and a molecular weight of 240.26 g/mol. Its IUPAC name is 1-methyl-N-[2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)ethyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-methyl-N-[2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)ethyl]pyrrolidine-2-carboxamide
PubChem CID137202849
Molecular FormulaC10H16N4O3
Molecular Weight240.26 g/mol
Exact Mass240.12
IUPAC Name1-methyl-N-[2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)ethyl]pyrrolidine-2-carboxamide
SMILESCN1CCCC1C(=O)NCCc1noc(=O)[nH]1
InChIInChI=1S/C10H16N4O3/c1-14-6-2-3-7(14)9(15)11-5-4-8-12-10(16)17-13-8/h7H,2-6H2,1H3,(H,11,15)(H,12,13,16)
InChIKeyVDWBKZBUDZYMDO-UHFFFAOYSA-N
XLogP-0.88
TPSA91.23 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.26
LogP ≤ 5-0.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(1S,5R)-N-[2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)ethyl]-3-oxabicyclo[3.1.0]hexane-6-carboxamide
CID 154865848
5-bromo-1-methyl-N-[2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)ethyl]pyrazole-4-carboxamide
CID 166234663
(2S)-1-methyl-N-(3-methylbutyl)pyrrolidine-2-carboxamide
CID 139684981
N-(3-hydroxy-3-methylbutyl)-1-methylpyrrolidine-2-carboxamide
CID 130257130
N-[2-(dimethylamino)ethyl]-1-methylpyrrolidine-2-carboxamide;ethane
CID 143685494
1-methyl-N-(2-pyrazin-2-ylethyl)azepane-2-carboxamide
CID 72838302
N-butyl-1-methylpyrrolidine-2-carboxamide;ethane;formaldehyde
CID 142213067
N-[2-(2,4-dichlorophenyl)ethyl]-1-methylpyrrolidine-2-carboxamide
CID 110856253
2-(1-hydroxycyclohexyl)-N-[2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)ethyl]acetamide
CID 137202884
1-methyl-N-pent-4-ynylpyrrolidine-2-carboxamide
CID 143354246
4-methyl-2-(oxan-3-yl)-N-[2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)ethyl]-1,3-thiazole-5-carboxamide
CID 137207634
1-amino-3-[2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)ethyl]thiourea
CID 137199034

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)ethyl]pyrrolidine-2-carboxamide?
The IUPAC name of 1-methyl-N-[2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)ethyl]pyrrolidine-2-carboxamide (CID 137202849) is 1-methyl-N-[2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)ethyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for 1-methyl-N-[2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)ethyl]pyrrolidine-2-carboxamide?
The canonical SMILES for 1-methyl-N-[2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)ethyl]pyrrolidine-2-carboxamide is CN1CCCC1C(=O)NCCc1noc(=O)[nH]1.
What is the InChIKey of 1-methyl-N-[2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)ethyl]pyrrolidine-2-carboxamide?
The InChIKey is VDWBKZBUDZYMDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O3/c1-14-6-2-3-7(14)9(15)11-5-4-8-12-10(16)17-13-8/h7H,2-6H2,1H3,(H,11,15)(H,12,13,16).
What are the key properties of 1-methyl-N-[2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)ethyl]pyrrolidine-2-carboxamide?
1-methyl-N-[2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)ethyl]pyrrolidine-2-carboxamide has a molecular weight of 240.26 g/mol, XLogP of -0.88, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)ethyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 137202849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).