3-pyrrolidin-2-yl-1H-quinolin-2-one

C13H14N2O — CID 84621897

IUPAC3-pyrrolidin-2-yl-1H-quinolin-2-one
SMILESO=c1[nH]c2ccccc2cc1C1CCCN1
InChIInChI=1S/C13H14N2O/c16-13-10(12-6-3-7-14-12)8-9-4-1-2-5-11(9)15-13/h1-2,4-5,8,12,14H,3,6-7H2,(H,15,16)
InChIKeyQTIWJNOJZOMETI-UHFFFAOYSA-N
MW214.27 g/mol
LogP1.95
Rot. Bonds1

About 3-pyrrolidin-2-yl-1H-quinolin-2-one

3-pyrrolidin-2-yl-1H-quinolin-2-one (PubChem CID 84621897) has the molecular formula C13H14N2O and a molecular weight of 214.27 g/mol. Its IUPAC name is 3-pyrrolidin-2-yl-1H-quinolin-2-one.

Molecular Properties

Compound Name3-pyrrolidin-2-yl-1H-quinolin-2-one
PubChem CID84621897
Molecular FormulaC13H14N2O
Molecular Weight214.27 g/mol
Exact Mass214.11
IUPAC Name3-pyrrolidin-2-yl-1H-quinolin-2-one
SMILESO=c1[nH]c2ccccc2cc1C1CCCN1
InChIInChI=1S/C13H14N2O/c16-13-10(12-6-3-7-14-12)8-9-4-1-2-5-11(9)15-13/h1-2,4-5,8,12,14H,3,6-7H2,(H,15,16)
InChIKeyQTIWJNOJZOMETI-UHFFFAOYSA-N
XLogP1.95
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-pyrrolidin-2-yl-1H-quinolin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-pyrrolidin-2-yl-1H-quinolin-2-one?
The IUPAC name of 3-pyrrolidin-2-yl-1H-quinolin-2-one (CID 84621897) is 3-pyrrolidin-2-yl-1H-quinolin-2-one.
What is the SMILES notation for 3-pyrrolidin-2-yl-1H-quinolin-2-one?
The canonical SMILES for 3-pyrrolidin-2-yl-1H-quinolin-2-one is O=c1[nH]c2ccccc2cc1C1CCCN1.
What is the InChIKey of 3-pyrrolidin-2-yl-1H-quinolin-2-one?
The InChIKey is QTIWJNOJZOMETI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O/c16-13-10(12-6-3-7-14-12)8-9-4-1-2-5-11(9)15-13/h1-2,4-5,8,12,14H,3,6-7H2,(H,15,16).
What are the key properties of 3-pyrrolidin-2-yl-1H-quinolin-2-one?
3-pyrrolidin-2-yl-1H-quinolin-2-one has a molecular weight of 214.27 g/mol, XLogP of 1.95, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyrrolidin-2-yl-1H-quinolin-2-one is sourced from PubChem (CID 84621897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).