(5S)-5-[2-(furan-2-yl)-2-oxoethyl]pyrrolidin-2-one

C10H11NO3 — CID 11608079

IUPAC(5S)-5-[2-(furan-2-yl)-2-oxoethyl]pyrrolidin-2-one
SMILESO=C1CC[C@@H](CC(=O)c2ccco2)N1
InChIInChI=1S/C10H11NO3/c12-8(9-2-1-5-14-9)6-7-3-4-10(13)11-7/h1-2,5,7H,3-4,6H2,(H,11,13)/t7-/m0/s1
InChIKeyCPYKXNTXHHYFKD-ZETCQYMHSA-N
MW193.20 g/mol
LogP1.13
Rot. Bonds3

About (5S)-5-[2-(furan-2-yl)-2-oxoethyl]pyrrolidin-2-one

(5S)-5-[2-(furan-2-yl)-2-oxoethyl]pyrrolidin-2-one (PubChem CID 11608079) has the molecular formula C10H11NO3 and a molecular weight of 193.20 g/mol. Its IUPAC name is (5S)-5-[2-(furan-2-yl)-2-oxoethyl]pyrrolidin-2-one.

Molecular Properties

Compound Name(5S)-5-[2-(furan-2-yl)-2-oxoethyl]pyrrolidin-2-one
PubChem CID11608079
Molecular FormulaC10H11NO3
Molecular Weight193.20 g/mol
Exact Mass193.07
IUPAC Name(5S)-5-[2-(furan-2-yl)-2-oxoethyl]pyrrolidin-2-one
SMILESO=C1CC[C@@H](CC(=O)c2ccco2)N1
InChIInChI=1S/C10H11NO3/c12-8(9-2-1-5-14-9)6-7-3-4-10(13)11-7/h1-2,5,7H,3-4,6H2,(H,11,13)/t7-/m0/s1
InChIKeyCPYKXNTXHHYFKD-ZETCQYMHSA-N
XLogP1.13
TPSA59.31 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.20
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(furan-2-yl)-2-thiomorpholin-3-ylethanone
CID 116586671
2-(3-aminocyclopentyl)-1-(furan-2-yl)ethanone
CID 130719938
(5R)-5-benzylpyrrolidin-2-one
CID 740530
1-cyclopropyl-3-(furan-2-yl)propane-1,3-dione
CID 43138918
1-(furan-2-yl)-2-[[(2R)-pyrrolidin-2-yl]methylamino]ethanone
CID 97165678
1-(furan-2-yl)-2-[[(3S)-pyrrolidin-3-yl]methylamino]ethanone
CID 97165702
1-[2-(furan-2-yl)-2-oxoethyl]-1,4-diazepan-5-one
CID 63002909
methyl 2-[(2S)-5-oxopyrrolidin-2-yl]acetate
CID 10877378
2-[2-(furan-2-yl)-2-oxoethyl]-1,3,4,7,8,8a-hexahydropyrrolo[1,2-a]pyrazin-6-one
CID 82863884
4-bromo-1-(furan-2-yl)butan-1-one
CID 3503830
N-[2-oxo-2-[(6-oxopiperidin-3-yl)amino]ethyl]furan-2-carboxamide
CID 55211401
N-[1-(5-oxopyrrolidine-2-carbonyl)piperidin-4-yl]furan-2-carboxamide
CID 110821316

Frequently Asked Questions

What is the IUPAC name of (5S)-5-[2-(furan-2-yl)-2-oxoethyl]pyrrolidin-2-one?
The IUPAC name of (5S)-5-[2-(furan-2-yl)-2-oxoethyl]pyrrolidin-2-one (CID 11608079) is (5S)-5-[2-(furan-2-yl)-2-oxoethyl]pyrrolidin-2-one.
What is the SMILES notation for (5S)-5-[2-(furan-2-yl)-2-oxoethyl]pyrrolidin-2-one?
The canonical SMILES for (5S)-5-[2-(furan-2-yl)-2-oxoethyl]pyrrolidin-2-one is O=C1CC[C@@H](CC(=O)c2ccco2)N1.
What is the InChIKey of (5S)-5-[2-(furan-2-yl)-2-oxoethyl]pyrrolidin-2-one?
The InChIKey is CPYKXNTXHHYFKD-ZETCQYMHSA-N. The full InChI is InChI=1S/C10H11NO3/c12-8(9-2-1-5-14-9)6-7-3-4-10(13)11-7/h1-2,5,7H,3-4,6H2,(H,11,13)/t7-/m0/s1.
What are the key properties of (5S)-5-[2-(furan-2-yl)-2-oxoethyl]pyrrolidin-2-one?
(5S)-5-[2-(furan-2-yl)-2-oxoethyl]pyrrolidin-2-one has a molecular weight of 193.20 g/mol, XLogP of 1.13, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-5-[2-(furan-2-yl)-2-oxoethyl]pyrrolidin-2-one is sourced from PubChem (CID 11608079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).