5-(1-methylpyrrolidin-2-yl)pyridine-2-carboxylic acid

C11H14N2O2 — CID 10726960

IUPAC5-(1-methylpyrrolidin-2-yl)pyridine-2-carboxylic acid
SMILESCN1CCCC1c1ccc(C(=O)O)nc1
InChIInChI=1S/C11H14N2O2/c1-13-6-2-3-10(13)8-4-5-9(11(14)15)12-7-8/h4-5,7,10H,2-3,6H2,1H3,(H,14,15)
InChIKeyZLAXYPFUZRJJEU-UHFFFAOYSA-N
MW206.25 g/mol
LogP1.55
Rot. Bonds2

About 5-(1-methylpyrrolidin-2-yl)pyridine-2-carboxylic acid

5-(1-methylpyrrolidin-2-yl)pyridine-2-carboxylic acid (PubChem CID 10726960) has the molecular formula C11H14N2O2 and a molecular weight of 206.25 g/mol. Its IUPAC name is 5-(1-methylpyrrolidin-2-yl)pyridine-2-carboxylic acid.

Molecular Properties

Compound Name5-(1-methylpyrrolidin-2-yl)pyridine-2-carboxylic acid
PubChem CID10726960
Molecular FormulaC11H14N2O2
Molecular Weight206.25 g/mol
Exact Mass206.11
IUPAC Name5-(1-methylpyrrolidin-2-yl)pyridine-2-carboxylic acid
SMILESCN1CCCC1c1ccc(C(=O)O)nc1
InChIInChI=1S/C11H14N2O2/c1-13-6-2-3-10(13)8-4-5-9(11(14)15)12-7-8/h4-5,7,10H,2-3,6H2,1H3,(H,14,15)
InChIKeyZLAXYPFUZRJJEU-UHFFFAOYSA-N
XLogP1.55
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 1018
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Isoquinoline-3-carboxylic acid
CID 124656
5-Ethylquinolinic acid
CID 113606
Phenopicolinic acid
CID 3043792
2-Carboxy-3-pyridineacetic acid
CID 3080554
4-(2,5-Dimethyl-Pyrrol-1-Ylmethyl)-Benzoic Acid
CID 659752
2,5-Dimethyl-1-[(pyridin-4-yl)methyl]-1H-pyrrole-3-carboxylic acid
CID 2736289
2-Pyridinecarboxylic acid, hydrochloride (1:1)
CID 71559
4-(Dimethylamino)pyridine-2-carboxylic acid
CID 2050134

Frequently Asked Questions

What is the IUPAC name of 5-(1-methylpyrrolidin-2-yl)pyridine-2-carboxylic acid?
The IUPAC name of 5-(1-methylpyrrolidin-2-yl)pyridine-2-carboxylic acid (CID 10726960) is 5-(1-methylpyrrolidin-2-yl)pyridine-2-carboxylic acid.
What is the SMILES notation for 5-(1-methylpyrrolidin-2-yl)pyridine-2-carboxylic acid?
The canonical SMILES for 5-(1-methylpyrrolidin-2-yl)pyridine-2-carboxylic acid is CN1CCCC1c1ccc(C(=O)O)nc1.
What is the InChIKey of 5-(1-methylpyrrolidin-2-yl)pyridine-2-carboxylic acid?
The InChIKey is ZLAXYPFUZRJJEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2/c1-13-6-2-3-10(13)8-4-5-9(11(14)15)12-7-8/h4-5,7,10H,2-3,6H2,1H3,(H,14,15).
What are the key properties of 5-(1-methylpyrrolidin-2-yl)pyridine-2-carboxylic acid?
5-(1-methylpyrrolidin-2-yl)pyridine-2-carboxylic acid has a molecular weight of 206.25 g/mol, XLogP of 1.55, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-methylpyrrolidin-2-yl)pyridine-2-carboxylic acid is sourced from PubChem (CID 10726960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).