1-(2-pyridin-3-ylethyl)pyrrolidin-2-one

C11H14N2O — CID 59074969

IUPAC1-(2-pyridin-3-ylethyl)pyrrolidin-2-one
SMILESO=C1CCCN1CCc1cccnc1
InChIInChI=1S/C11H14N2O/c14-11-4-2-7-13(11)8-5-10-3-1-6-12-9-10/h1,3,6,9H,2,4-5,7-8H2
InChIKeyHXTZGKCBKNOFAG-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.25
Rot. Bonds3

About 1-(2-pyridin-3-ylethyl)pyrrolidin-2-one

1-(2-pyridin-3-ylethyl)pyrrolidin-2-one (PubChem CID 59074969) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is 1-(2-pyridin-3-ylethyl)pyrrolidin-2-one.

Molecular Properties

Compound Name1-(2-pyridin-3-ylethyl)pyrrolidin-2-one
PubChem CID59074969
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC Name1-(2-pyridin-3-ylethyl)pyrrolidin-2-one
SMILESO=C1CCCN1CCc1cccnc1
InChIInChI=1S/C11H14N2O/c14-11-4-2-7-13(11)8-5-10-3-1-6-12-9-10/h1,3,6,9H,2,4-5,7-8H2
InChIKeyHXTZGKCBKNOFAG-UHFFFAOYSA-N
XLogP1.25
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-pyridin-3-ylethyl)pyrrolidin-2-imine
CID 60914978
1-[2-[2-phenylethyl(pyridin-3-ylmethyl)amino]ethyl]pyrrolidin-2-one
CID 134700180
3-(2-pyrrolidin-1-ylethyl)pyridine
CID 23273673
1-[4-oxo-4-[4-(pyridin-3-ylmethyl)piperazin-1-yl]butyl]pyrrolidin-2-one
CID 74236287
1-[2-(4-aminophenyl)ethyl]pyrrolidin-2-one
CID 10584340
1-(3-phenylpropyl)pyrrolidin-2-one;dihydrochloride
CID 142636287
6-oxo-1-(2-pyridin-3-ylethyl)-4,5-dihydropyridazine-3-carboxylic acid
CID 63262742
1-(2-pyridin-3-ylprop-2-enyl)pyrrolidin-2-one
CID 22733091
9-(3-methylsulfanylpropanoyl)-2-(2-pyridin-3-ylethyl)-2,9-diazaspiro[5.5]undecan-3-one
CID 72888632
5-oxo-1-(2-pyridin-3-ylethyl)pyrrolidine-3-sulfonyl fluoride
CID 168714925
3-(3-pyrrolidin-1-ylpropyl)pyridine
CID 70096862
9-[(2R)-2-hydroxybutanoyl]-2-(2-pyridin-3-ylethyl)-2,9-diazaspiro[5.5]undecan-3-one
CID 97122526

Frequently Asked Questions

What is the IUPAC name of 1-(2-pyridin-3-ylethyl)pyrrolidin-2-one?
The IUPAC name of 1-(2-pyridin-3-ylethyl)pyrrolidin-2-one (CID 59074969) is 1-(2-pyridin-3-ylethyl)pyrrolidin-2-one.
What is the SMILES notation for 1-(2-pyridin-3-ylethyl)pyrrolidin-2-one?
The canonical SMILES for 1-(2-pyridin-3-ylethyl)pyrrolidin-2-one is O=C1CCCN1CCc1cccnc1.
What is the InChIKey of 1-(2-pyridin-3-ylethyl)pyrrolidin-2-one?
The InChIKey is HXTZGKCBKNOFAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O/c14-11-4-2-7-13(11)8-5-10-3-1-6-12-9-10/h1,3,6,9H,2,4-5,7-8H2.
What are the key properties of 1-(2-pyridin-3-ylethyl)pyrrolidin-2-one?
1-(2-pyridin-3-ylethyl)pyrrolidin-2-one has a molecular weight of 190.25 g/mol, XLogP of 1.25, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-pyridin-3-ylethyl)pyrrolidin-2-one is sourced from PubChem (CID 59074969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).