(2-oxo-2-pyrrolidin-1-ylethyl) furan-2-carboxylate

C11H13NO4 — CID 2351711

IUPAC(2-oxo-2-pyrrolidin-1-ylethyl) furan-2-carboxylate
SMILESO=C(OCC(=O)N1CCCC1)c1ccco1
InChIInChI=1S/C11H13NO4/c13-10(12-5-1-2-6-12)8-16-11(14)9-4-3-7-15-9/h3-4,7H,1-2,5-6,8H2
InChIKeyQITWVRUQHZXGBP-UHFFFAOYSA-N
MW223.23 g/mol
LogP1.06
Rot. Bonds3

About (2-oxo-2-pyrrolidin-1-ylethyl) furan-2-carboxylate

(2-oxo-2-pyrrolidin-1-ylethyl) furan-2-carboxylate (PubChem CID 2351711) has the molecular formula C11H13NO4 and a molecular weight of 223.23 g/mol. Its IUPAC name is (2-oxo-2-pyrrolidin-1-ylethyl) furan-2-carboxylate.

Molecular Properties

Compound Name(2-oxo-2-pyrrolidin-1-ylethyl) furan-2-carboxylate
PubChem CID2351711
Molecular FormulaC11H13NO4
Molecular Weight223.23 g/mol
Exact Mass223.08
IUPAC Name(2-oxo-2-pyrrolidin-1-ylethyl) furan-2-carboxylate
SMILESO=C(OCC(=O)N1CCCC1)c1ccco1
InChIInChI=1S/C11H13NO4/c13-10(12-5-1-2-6-12)8-16-11(14)9-4-3-7-15-9/h3-4,7H,1-2,5-6,8H2
InChIKeyQITWVRUQHZXGBP-UHFFFAOYSA-N
XLogP1.06
TPSA59.75 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.23
LogP ≤ 51.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (2-oxo-2-pyrrolidin-1-ylethyl) furan-2-carboxylate 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

[2-(4-methylpiperidin-1-yl)-2-oxoethyl] (E)-3-(furan-2-yl)prop-2-enoate
CID 2099363
(1-Methylpiperidin-4-yl) furan-2-carboxylate;hydrochloride
CID 2952941
Furan-2-carboxylic acid 1-cyclopentylcarbamoyl-ethyl ester
CID 3220201
Furan-2-carboxylic acid 1-cyclopentylcarbamoyl-2-methyl-propyl ester
CID 3220206
Furan-2-carboxylic acid 1-cyclopentylcarbamoyl-propyl ester
CID 3220216
Furan-2-carboxylic acid 1-methyl-2-(4-methyl-piperidin-1-yl)-ethyl ester
CID 24792334
(2S)-1-(furan-2-carbonyl)pyrrolidine-2-carboxylic acid
CID 2526737
[2-oxo-2-(propylamino)ethyl] (E)-3-(furan-2-yl)prop-2-enoate
CID 2421408
[2-(Cyclohexylmethylamino)-2-oxoethyl] furan-2-carboxylate
CID 7486753
[2-[2-[[2-(Furan-2-carbonyloxy)acetyl]amino]ethylamino]-2-oxoethyl] furan-2-carboxylate
CID 7814068
Furan-2-carboxylic acid cyclopentylcarbamoylmethyl ester
CID 1470227
(2-oxo-2-piperidin-1-ylethyl) (E)-3-(furan-2-yl)prop-2-enoate
CID 2371620

Frequently Asked Questions

What is the IUPAC name of (2-oxo-2-pyrrolidin-1-ylethyl) furan-2-carboxylate?
The IUPAC name of (2-oxo-2-pyrrolidin-1-ylethyl) furan-2-carboxylate (CID 2351711) is (2-oxo-2-pyrrolidin-1-ylethyl) furan-2-carboxylate.
What is the SMILES notation for (2-oxo-2-pyrrolidin-1-ylethyl) furan-2-carboxylate?
The canonical SMILES for (2-oxo-2-pyrrolidin-1-ylethyl) furan-2-carboxylate is O=C(OCC(=O)N1CCCC1)c1ccco1.
What is the InChIKey of (2-oxo-2-pyrrolidin-1-ylethyl) furan-2-carboxylate?
The InChIKey is QITWVRUQHZXGBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO4/c13-10(12-5-1-2-6-12)8-16-11(14)9-4-3-7-15-9/h3-4,7H,1-2,5-6,8H2.
What are the key properties of (2-oxo-2-pyrrolidin-1-ylethyl) furan-2-carboxylate?
(2-oxo-2-pyrrolidin-1-ylethyl) furan-2-carboxylate has a molecular weight of 223.23 g/mol, XLogP of 1.06, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-oxo-2-pyrrolidin-1-ylethyl) furan-2-carboxylate is sourced from PubChem (CID 2351711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).