2-(pyridin-2-ylmethyl)pyrrolidine-2-carboxylic acid

C11H14N2O2 — CID 53398196

IUPAC2-(pyridin-2-ylmethyl)pyrrolidine-2-carboxylic acid
SMILESO=C(O)C1(Cc2ccccn2)CCCN1
InChIInChI=1S/C11H14N2O2/c14-10(15)11(5-3-7-13-11)8-9-4-1-2-6-12-9/h1-2,4,6,13H,3,5,7-8H2,(H,14,15)
InChIKeyWQLOHNORKALADI-UHFFFAOYSA-N
MW206.25 g/mol
LogP0.83
Rot. Bonds3

About 2-(pyridin-2-ylmethyl)pyrrolidine-2-carboxylic acid

2-(pyridin-2-ylmethyl)pyrrolidine-2-carboxylic acid (PubChem CID 53398196) has the molecular formula C11H14N2O2 and a molecular weight of 206.25 g/mol. Its IUPAC name is 2-(pyridin-2-ylmethyl)pyrrolidine-2-carboxylic acid.

Molecular Properties

Compound Name2-(pyridin-2-ylmethyl)pyrrolidine-2-carboxylic acid
PubChem CID53398196
Molecular FormulaC11H14N2O2
Molecular Weight206.25 g/mol
Exact Mass206.11
IUPAC Name2-(pyridin-2-ylmethyl)pyrrolidine-2-carboxylic acid
SMILESO=C(O)C1(Cc2ccccn2)CCCN1
InChIInChI=1S/C11H14N2O2/c14-10(15)11(5-3-7-13-11)8-9-4-1-2-6-12-9/h1-2,4,6,13H,3,5,7-8H2,(H,14,15)
InChIKeyWQLOHNORKALADI-UHFFFAOYSA-N
XLogP0.83
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2-fluorophenyl)methyl]pyrrolidine-2-carboxylic acid
CID 53398104
(2R)-2-[(2-fluorophenyl)methyl]pyrrolidine-2-carboxylic acid
CID 2761825
2-[(2-fluorophenyl)methyl]pyrrolidine-2-carboxylic acid;hydrochloride
CID 53398103
N-ethyl-2-propyl-N-(pyridin-2-ylmethyl)pyrrolidine-2-carboxamide
CID 106975512
2-(naphthalen-1-ylmethyl)pyrrolidine-2-carboxylic acid;hydrochloride
CID 53398043
(2R)-2-[(4-fluorophenyl)methyl]pyrrolidine-2-carboxylic acid;hydrochloride
CID 2761830
(2R)-2-[[2-(trifluoromethyl)phenyl]methyl]pyrrolidine-2-carboxylic acid;hydrochloride
CID 2761894
(2R)-2-[(2-cyanophenyl)methyl]pyrrolidine-2-carboxylic acid
CID 2761904
2-[1-(pyridin-2-ylmethyl)cyclopropyl]acetic acid
CID 82403496
2-(phenylsulfanylmethyl)pyrrolidine-2-carboxylic acid
CID 141198596
(2S)-2-[(3,4-dichlorophenyl)methyl]pyrrolidine-2-carboxylic acid
CID 7145473
2-methyl-2-(pyridin-2-ylmethyl)azepane
CID 79118895

Frequently Asked Questions

What is the IUPAC name of 2-(pyridin-2-ylmethyl)pyrrolidine-2-carboxylic acid?
The IUPAC name of 2-(pyridin-2-ylmethyl)pyrrolidine-2-carboxylic acid (CID 53398196) is 2-(pyridin-2-ylmethyl)pyrrolidine-2-carboxylic acid.
What is the SMILES notation for 2-(pyridin-2-ylmethyl)pyrrolidine-2-carboxylic acid?
The canonical SMILES for 2-(pyridin-2-ylmethyl)pyrrolidine-2-carboxylic acid is O=C(O)C1(Cc2ccccn2)CCCN1.
What is the InChIKey of 2-(pyridin-2-ylmethyl)pyrrolidine-2-carboxylic acid?
The InChIKey is WQLOHNORKALADI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2/c14-10(15)11(5-3-7-13-11)8-9-4-1-2-6-12-9/h1-2,4,6,13H,3,5,7-8H2,(H,14,15).
What are the key properties of 2-(pyridin-2-ylmethyl)pyrrolidine-2-carboxylic acid?
2-(pyridin-2-ylmethyl)pyrrolidine-2-carboxylic acid has a molecular weight of 206.25 g/mol, XLogP of 0.83, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(pyridin-2-ylmethyl)pyrrolidine-2-carboxylic acid is sourced from PubChem (CID 53398196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).