2-(2-pyridin-2-ylpyrrolidin-1-yl)acetic acid

C11H14N2O2 — CID 131863720

IUPAC2-(2-pyridin-2-ylpyrrolidin-1-yl)acetic acid
SMILESO=C(O)CN1CCCC1c1ccccn1
InChIInChI=1S/C11H14N2O2/c14-11(15)8-13-7-3-5-10(13)9-4-1-2-6-12-9/h1-2,4,6,10H,3,5,7-8H2,(H,14,15)
InChIKeyXAXJVWKCBGXAEP-UHFFFAOYSA-N
MW206.25 g/mol
LogP1.30
Rot. Bonds3

About 2-(2-pyridin-2-ylpyrrolidin-1-yl)acetic acid

2-(2-pyridin-2-ylpyrrolidin-1-yl)acetic acid (PubChem CID 131863720) has the molecular formula C11H14N2O2 and a molecular weight of 206.25 g/mol. Its IUPAC name is 2-(2-pyridin-2-ylpyrrolidin-1-yl)acetic acid.

Molecular Properties

Compound Name2-(2-pyridin-2-ylpyrrolidin-1-yl)acetic acid
PubChem CID131863720
Molecular FormulaC11H14N2O2
Molecular Weight206.25 g/mol
Exact Mass206.11
IUPAC Name2-(2-pyridin-2-ylpyrrolidin-1-yl)acetic acid
SMILESO=C(O)CN1CCCC1c1ccccn1
InChIInChI=1S/C11H14N2O2/c14-11(15)8-13-7-3-5-10(13)9-4-1-2-6-12-9/h1-2,4,6,10H,3,5,7-8H2,(H,14,15)
InChIKeyXAXJVWKCBGXAEP-UHFFFAOYSA-N
XLogP1.30
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[(2S)-2-pyridin-2-ylpyrrolidin-1-yl]methyl]benzoic acid
CID 95200148
4-[[(2R)-2-pyridin-2-ylpyrrolidin-1-yl]methyl]-1H-pyrazole-5-carboxylic acid
CID 95550862
2-(2-phenylpiperidin-1-yl)acetic acid
CID 23201321
1-(2,3-dihydro-1,4-benzoxazin-4-yl)-2-(2-pyridin-2-ylpyrrolidin-1-yl)ethanone
CID 56885770
2-[(2S)-2-phenylpyrrolidin-1-yl]-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone
CID 41359979
2-[1-(2-methylpropyl)piperidin-2-yl]pyridine
CID 102538970
2-[(2S)-1-(pyridin-3-ylmethyl)pyrrolidin-2-yl]pyridine
CID 95841459
2-[(2R)-2-pyridin-2-ylpyrrolidin-1-yl]pyridine-3-carboxylic acid
CID 40637940
benzyl (2S)-2-pyridin-2-ylpyrrolidine-1-carboxylate
CID 14814122
2-[2-(2-methylpyrazol-3-yl)pyrrolidin-1-yl]acetic acid
CID 25247982
2-[(2S)-1-[(4-methylsulfonylphenyl)methyl]pyrrolidin-2-yl]pyridine
CID 99937922
2-(dimethylamino)-1-(2-pyridin-2-ylpyrrolidin-1-yl)ethanone
CID 73440457

Frequently Asked Questions

What is the IUPAC name of 2-(2-pyridin-2-ylpyrrolidin-1-yl)acetic acid?
The IUPAC name of 2-(2-pyridin-2-ylpyrrolidin-1-yl)acetic acid (CID 131863720) is 2-(2-pyridin-2-ylpyrrolidin-1-yl)acetic acid.
What is the SMILES notation for 2-(2-pyridin-2-ylpyrrolidin-1-yl)acetic acid?
The canonical SMILES for 2-(2-pyridin-2-ylpyrrolidin-1-yl)acetic acid is O=C(O)CN1CCCC1c1ccccn1.
What is the InChIKey of 2-(2-pyridin-2-ylpyrrolidin-1-yl)acetic acid?
The InChIKey is XAXJVWKCBGXAEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2/c14-11(15)8-13-7-3-5-10(13)9-4-1-2-6-12-9/h1-2,4,6,10H,3,5,7-8H2,(H,14,15).
What are the key properties of 2-(2-pyridin-2-ylpyrrolidin-1-yl)acetic acid?
2-(2-pyridin-2-ylpyrrolidin-1-yl)acetic acid has a molecular weight of 206.25 g/mol, XLogP of 1.30, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-pyridin-2-ylpyrrolidin-1-yl)acetic acid is sourced from PubChem (CID 131863720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).