4-[(1R)-1-(7-pyridin-2-ylquinolin-5-yl)oxyethyl]pyrrolidin-2-one

C20H19N3O2 — CID 71238246

IUPAC4-[(1R)-1-(7-pyridin-2-ylquinolin-5-yl)oxyethyl]pyrrolidin-2-one
SMILESC[C@@H](Oc1cc(-c2ccccn2)cc2ncccc12)C1CNC(=O)C1
InChIInChI=1S/C20H19N3O2/c1-13(15-11-20(24)23-12-15)25-19-10-14(17-6-2-3-7-21-17)9-18-16(19)5-4-8-22-18/h2-10,13,15H,11-12H2,1H3,(H,23,24)/t13-,15?/m1/s1
InChIKeyJFWWGRGDYNSADT-AFYYWNPRSA-N
MW333.39 g/mol
LogP3.20
Rot. Bonds4

About 4-[(1R)-1-(7-pyridin-2-ylquinolin-5-yl)oxyethyl]pyrrolidin-2-one

4-[(1R)-1-(7-pyridin-2-ylquinolin-5-yl)oxyethyl]pyrrolidin-2-one (PubChem CID 71238246) has the molecular formula C20H19N3O2 and a molecular weight of 333.39 g/mol. Its IUPAC name is 4-[(1R)-1-(7-pyridin-2-ylquinolin-5-yl)oxyethyl]pyrrolidin-2-one.

Molecular Properties

Compound Name4-[(1R)-1-(7-pyridin-2-ylquinolin-5-yl)oxyethyl]pyrrolidin-2-one
PubChem CID71238246
Molecular FormulaC20H19N3O2
Molecular Weight333.39 g/mol
Exact Mass333.15
IUPAC Name4-[(1R)-1-(7-pyridin-2-ylquinolin-5-yl)oxyethyl]pyrrolidin-2-one
SMILESC[C@@H](Oc1cc(-c2ccccn2)cc2ncccc12)C1CNC(=O)C1
InChIInChI=1S/C20H19N3O2/c1-13(15-11-20(24)23-12-15)25-19-10-14(17-6-2-3-7-21-17)9-18-16(19)5-4-8-22-18/h2-10,13,15H,11-12H2,1H3,(H,23,24)/t13-,15?/m1/s1
InChIKeyJFWWGRGDYNSADT-AFYYWNPRSA-N
XLogP3.20
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.39
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[(1R)-1-(7-pyridin-2-ylquinolin-5-yl)oxyethyl]pyrrolidin-2-one?
The IUPAC name of 4-[(1R)-1-(7-pyridin-2-ylquinolin-5-yl)oxyethyl]pyrrolidin-2-one (CID 71238246) is 4-[(1R)-1-(7-pyridin-2-ylquinolin-5-yl)oxyethyl]pyrrolidin-2-one.
What is the SMILES notation for 4-[(1R)-1-(7-pyridin-2-ylquinolin-5-yl)oxyethyl]pyrrolidin-2-one?
The canonical SMILES for 4-[(1R)-1-(7-pyridin-2-ylquinolin-5-yl)oxyethyl]pyrrolidin-2-one is C[C@@H](Oc1cc(-c2ccccn2)cc2ncccc12)C1CNC(=O)C1.
What is the InChIKey of 4-[(1R)-1-(7-pyridin-2-ylquinolin-5-yl)oxyethyl]pyrrolidin-2-one?
The InChIKey is JFWWGRGDYNSADT-AFYYWNPRSA-N. The full InChI is InChI=1S/C20H19N3O2/c1-13(15-11-20(24)23-12-15)25-19-10-14(17-6-2-3-7-21-17)9-18-16(19)5-4-8-22-18/h2-10,13,15H,11-12H2,1H3,(H,23,24)/t13-,15?/m1/s1.
What are the key properties of 4-[(1R)-1-(7-pyridin-2-ylquinolin-5-yl)oxyethyl]pyrrolidin-2-one?
4-[(1R)-1-(7-pyridin-2-ylquinolin-5-yl)oxyethyl]pyrrolidin-2-one has a molecular weight of 333.39 g/mol, XLogP of 3.20, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1R)-1-(7-pyridin-2-ylquinolin-5-yl)oxyethyl]pyrrolidin-2-one is sourced from PubChem (CID 71238246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).