(2R)-2-(furan-2-yl)pyrrolidine-2-carboxylic acid

C9H11NO3 — CID 70544548

IUPAC(2R)-2-(furan-2-yl)pyrrolidine-2-carboxylic acid
SMILESO=C(O)[C@]1(c2ccco2)CCCN1
InChIInChI=1S/C9H11NO3/c11-8(12)9(4-2-5-10-9)7-3-1-6-13-7/h1,3,6,10H,2,4-5H2,(H,11,12)/t9-/m1/s1
InChIKeyYIFVHPOCYBGPAW-SECBINFHSA-N
MW181.19 g/mol
LogP0.94
Rot. Bonds2

About (2R)-2-(furan-2-yl)pyrrolidine-2-carboxylic acid

(2R)-2-(furan-2-yl)pyrrolidine-2-carboxylic acid (PubChem CID 70544548) has the molecular formula C9H11NO3 and a molecular weight of 181.19 g/mol. Its IUPAC name is (2R)-2-(furan-2-yl)pyrrolidine-2-carboxylic acid.

Molecular Properties

Compound Name(2R)-2-(furan-2-yl)pyrrolidine-2-carboxylic acid
PubChem CID70544548
Molecular FormulaC9H11NO3
Molecular Weight181.19 g/mol
Exact Mass181.07
IUPAC Name(2R)-2-(furan-2-yl)pyrrolidine-2-carboxylic acid
SMILESO=C(O)[C@]1(c2ccco2)CCCN1
InChIInChI=1S/C9H11NO3/c11-8(12)9(4-2-5-10-9)7-3-1-6-13-7/h1,3,6,10H,2,4-5H2,(H,11,12)/t9-/m1/s1
InChIKeyYIFVHPOCYBGPAW-SECBINFHSA-N
XLogP0.94
TPSA62.47 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.19
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-hydroxyphenyl)pyrrolidine-2-carboxylic acid
CID 115103424
(2R)-2-(4-chlorophenyl)pyrrolidine-2-carboxylic acid
CID 141351332
3-(furan-2-yl)-2-oxopyrrolidine-3-carboxylic acid
CID 83531251
(2S)-2-pyridin-3-ylpyrrolidine-2-carboxylic acid
CID 141351322
2-(3-fluorophenyl)pyrrolidine-2-carboxylic acid
CID 70487750
2-(furan-2-yl)oxolane-2-carboxylic acid
CID 178200785
2-tert-butyl-2-(furan-2-yl)pyrrolidine
CID 66466753
2-(2-methoxyphenyl)pyrrolidine-2-carboxylic acid
CID 70486714
1-(2-phenylpyrrolidin-2-yl)ethanone
CID 91015511
(2S)-2-(1H-indol-3-yl)pyrrolidine-2-carboxylic acid
CID 67713185
(2-ethylpyrrolidin-2-yl)-(furan-2-yl)methanone
CID 116608283
4-(furan-2-yl)-4-methylpiperidine
CID 83815867

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(furan-2-yl)pyrrolidine-2-carboxylic acid?
The IUPAC name of (2R)-2-(furan-2-yl)pyrrolidine-2-carboxylic acid (CID 70544548) is (2R)-2-(furan-2-yl)pyrrolidine-2-carboxylic acid.
What is the SMILES notation for (2R)-2-(furan-2-yl)pyrrolidine-2-carboxylic acid?
The canonical SMILES for (2R)-2-(furan-2-yl)pyrrolidine-2-carboxylic acid is O=C(O)[C@]1(c2ccco2)CCCN1.
What is the InChIKey of (2R)-2-(furan-2-yl)pyrrolidine-2-carboxylic acid?
The InChIKey is YIFVHPOCYBGPAW-SECBINFHSA-N. The full InChI is InChI=1S/C9H11NO3/c11-8(12)9(4-2-5-10-9)7-3-1-6-13-7/h1,3,6,10H,2,4-5H2,(H,11,12)/t9-/m1/s1.
What are the key properties of (2R)-2-(furan-2-yl)pyrrolidine-2-carboxylic acid?
(2R)-2-(furan-2-yl)pyrrolidine-2-carboxylic acid has a molecular weight of 181.19 g/mol, XLogP of 0.94, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(furan-2-yl)pyrrolidine-2-carboxylic acid is sourced from PubChem (CID 70544548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).