pyrrolidin-1-yl pyridine-2-carboxylate

C10H12N2O2 — CID 118695121

IUPACpyrrolidin-1-yl pyridine-2-carboxylate
SMILESO=C(ON1CCCC1)c1ccccn1
InChIInChI=1S/C10H12N2O2/c13-10(9-5-1-2-6-11-9)14-12-7-3-4-8-12/h1-2,5-6H,3-4,7-8H2
InChIKeyYRFJBEUEXVSTOD-UHFFFAOYSA-N
MW192.22 g/mol
LogP1.25
Rot. Bonds2

About pyrrolidin-1-yl pyridine-2-carboxylate

pyrrolidin-1-yl pyridine-2-carboxylate (PubChem CID 118695121) has the molecular formula C10H12N2O2 and a molecular weight of 192.22 g/mol. Its IUPAC name is pyrrolidin-1-yl pyridine-2-carboxylate.

Molecular Properties

Compound Namepyrrolidin-1-yl pyridine-2-carboxylate
PubChem CID118695121
Molecular FormulaC10H12N2O2
Molecular Weight192.22 g/mol
Exact Mass192.09
IUPAC Namepyrrolidin-1-yl pyridine-2-carboxylate
SMILESO=C(ON1CCCC1)c1ccccn1
InChIInChI=1S/C10H12N2O2/c13-10(9-5-1-2-6-11-9)14-12-7-3-4-8-12/h1-2,5-6H,3-4,7-8H2
InChIKeyYRFJBEUEXVSTOD-UHFFFAOYSA-N
XLogP1.25
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 51.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

piperazin-1-yl pyridine-2-carboxylate;dihydrochloride
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[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl] pyridine-2-carboxylate
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1-(azepan-1-yl)-2-pyridin-2-ylethane-1,2-dione
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N-pyrrolidin-1-ylpyridine-2-carboxamide
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gadolinium;pyridine-2-carboxylic acid
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[4-(piperidine-1-carbonyl)piperazin-1-yl]-pyridin-2-ylmethanone
CID 30346280
pyridine-2-carboxylic acid;tungsten
CID 88770661
CID 173156131
CID 173156131
CID 175246691
CID 175246691
hafnium;pyridine-2-carboxylic acid
CID 175130925
europium;pyridine-2-carboxylic acid
CID 174808227
morpholin-4-ylmethyl pyridine-2-carboxylate
CID 67423863

Frequently Asked Questions

What is the IUPAC name of pyrrolidin-1-yl pyridine-2-carboxylate?
The IUPAC name of pyrrolidin-1-yl pyridine-2-carboxylate (CID 118695121) is pyrrolidin-1-yl pyridine-2-carboxylate.
What is the SMILES notation for pyrrolidin-1-yl pyridine-2-carboxylate?
The canonical SMILES for pyrrolidin-1-yl pyridine-2-carboxylate is O=C(ON1CCCC1)c1ccccn1.
What is the InChIKey of pyrrolidin-1-yl pyridine-2-carboxylate?
The InChIKey is YRFJBEUEXVSTOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O2/c13-10(9-5-1-2-6-11-9)14-12-7-3-4-8-12/h1-2,5-6H,3-4,7-8H2.
What are the key properties of pyrrolidin-1-yl pyridine-2-carboxylate?
pyrrolidin-1-yl pyridine-2-carboxylate has a molecular weight of 192.22 g/mol, XLogP of 1.25, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for pyrrolidin-1-yl pyridine-2-carboxylate is sourced from PubChem (CID 118695121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).