4-[3-(cyclopentylmethyl)-1,2,4-oxadiazol-5-yl]-1-(2-methoxyethyl)pyrrolidin-2-one

C15H23N3O3 — CID 154759331

IUPAC4-[3-(cyclopentylmethyl)-1,2,4-oxadiazol-5-yl]-1-(2-methoxyethyl)pyrrolidin-2-one
SMILESCOCCN1CC(c2nc(CC3CCCC3)no2)CC1=O
InChIInChI=1S/C15H23N3O3/c1-20-7-6-18-10-12(9-14(18)19)15-16-13(17-21-15)8-11-4-2-3-5-11/h11-12H,2-10H2,1H3
InChIKeyWUGGJWDARMMVON-UHFFFAOYSA-N
MW293.37 g/mol
LogP1.76
Rot. Bonds6

About 4-[3-(cyclopentylmethyl)-1,2,4-oxadiazol-5-yl]-1-(2-methoxyethyl)pyrrolidin-2-one

4-[3-(cyclopentylmethyl)-1,2,4-oxadiazol-5-yl]-1-(2-methoxyethyl)pyrrolidin-2-one (PubChem CID 154759331) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is 4-[3-(cyclopentylmethyl)-1,2,4-oxadiazol-5-yl]-1-(2-methoxyethyl)pyrrolidin-2-one.

Molecular Properties

Compound Name4-[3-(cyclopentylmethyl)-1,2,4-oxadiazol-5-yl]-1-(2-methoxyethyl)pyrrolidin-2-one
PubChem CID154759331
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC Name4-[3-(cyclopentylmethyl)-1,2,4-oxadiazol-5-yl]-1-(2-methoxyethyl)pyrrolidin-2-one
SMILESCOCCN1CC(c2nc(CC3CCCC3)no2)CC1=O
InChIInChI=1S/C15H23N3O3/c1-20-7-6-18-10-12(9-14(18)19)15-16-13(17-21-15)8-11-4-2-3-5-11/h11-12H,2-10H2,1H3
InChIKeyWUGGJWDARMMVON-UHFFFAOYSA-N
XLogP1.76
TPSA68.46 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 51.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[3-(cyclopentylmethyl)-1,2,4-oxadiazol-5-yl]-1-(2-methoxyethyl)pyrrolidin-2-one?
The IUPAC name of 4-[3-(cyclopentylmethyl)-1,2,4-oxadiazol-5-yl]-1-(2-methoxyethyl)pyrrolidin-2-one (CID 154759331) is 4-[3-(cyclopentylmethyl)-1,2,4-oxadiazol-5-yl]-1-(2-methoxyethyl)pyrrolidin-2-one.
What is the SMILES notation for 4-[3-(cyclopentylmethyl)-1,2,4-oxadiazol-5-yl]-1-(2-methoxyethyl)pyrrolidin-2-one?
The canonical SMILES for 4-[3-(cyclopentylmethyl)-1,2,4-oxadiazol-5-yl]-1-(2-methoxyethyl)pyrrolidin-2-one is COCCN1CC(c2nc(CC3CCCC3)no2)CC1=O.
What is the InChIKey of 4-[3-(cyclopentylmethyl)-1,2,4-oxadiazol-5-yl]-1-(2-methoxyethyl)pyrrolidin-2-one?
The InChIKey is WUGGJWDARMMVON-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3/c1-20-7-6-18-10-12(9-14(18)19)15-16-13(17-21-15)8-11-4-2-3-5-11/h11-12H,2-10H2,1H3.
What are the key properties of 4-[3-(cyclopentylmethyl)-1,2,4-oxadiazol-5-yl]-1-(2-methoxyethyl)pyrrolidin-2-one?
4-[3-(cyclopentylmethyl)-1,2,4-oxadiazol-5-yl]-1-(2-methoxyethyl)pyrrolidin-2-one has a molecular weight of 293.37 g/mol, XLogP of 1.76, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(cyclopentylmethyl)-1,2,4-oxadiazol-5-yl]-1-(2-methoxyethyl)pyrrolidin-2-one is sourced from PubChem (CID 154759331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).