4-[(7-pyridin-2-ylquinolin-5-yl)oxymethyl]pyrrolidin-2-one

C19H17N3O2 — CID 78045686

IUPAC4-[(7-pyridin-2-ylquinolin-5-yl)oxymethyl]pyrrolidin-2-one
SMILESO=C1CC(COc2cc(-c3ccccn3)cc3ncccc23)CN1
InChIInChI=1S/C19H17N3O2/c23-19-8-13(11-22-19)12-24-18-10-14(16-5-1-2-6-20-16)9-17-15(18)4-3-7-21-17/h1-7,9-10,13H,8,11-12H2,(H,22,23)
InChIKeyQQULFUXVIPHPAG-UHFFFAOYSA-N
MW319.36 g/mol
LogP2.81
Rot. Bonds4

About 4-[(7-pyridin-2-ylquinolin-5-yl)oxymethyl]pyrrolidin-2-one

4-[(7-pyridin-2-ylquinolin-5-yl)oxymethyl]pyrrolidin-2-one (PubChem CID 78045686) has the molecular formula C19H17N3O2 and a molecular weight of 319.36 g/mol. Its IUPAC name is 4-[(7-pyridin-2-ylquinolin-5-yl)oxymethyl]pyrrolidin-2-one.

Molecular Properties

Compound Name4-[(7-pyridin-2-ylquinolin-5-yl)oxymethyl]pyrrolidin-2-one
PubChem CID78045686
Molecular FormulaC19H17N3O2
Molecular Weight319.36 g/mol
Exact Mass319.13
IUPAC Name4-[(7-pyridin-2-ylquinolin-5-yl)oxymethyl]pyrrolidin-2-one
SMILESO=C1CC(COc2cc(-c3ccccn3)cc3ncccc23)CN1
InChIInChI=1S/C19H17N3O2/c23-19-8-13(11-22-19)12-24-18-10-14(16-5-1-2-6-20-16)9-17-15(18)4-3-7-21-17/h1-7,9-10,13H,8,11-12H2,(H,22,23)
InChIKeyQQULFUXVIPHPAG-UHFFFAOYSA-N
XLogP2.81
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.36
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[[7-(3,4-dimethoxyphenyl)quinolin-5-yl]oxymethyl]pyrrolidin-2-one
CID 78045097
4-[[7-(1-methylpyrazol-4-yl)quinolin-5-yl]oxymethyl]pyrrolidin-2-one
CID 144516403
4-[[7-[6-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]quinolin-5-yl]oxymethyl]pyrrolidin-2-one
CID 123324119
4-[[7-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]quinolin-5-yl]oxymethyl]pyrrolidin-2-one
CID 144516347
(4R)-4-[2-(7-quinolin-6-ylquinolin-5-yl)oxyethyl]pyrrolidin-2-one
CID 71240051
ethane;5-[[7-(3,4,5-trimethoxyphenyl)quinolin-5-yl]oxymethyl]piperidin-2-one
CID 144516320
4-[[7-[6-(oxan-4-yloxy)-3-pyridinyl]quinolin-5-yl]oxymethyl]pyrrolidin-2-one
CID 144516379
4-[[7-(4-fluoro-3-methoxyphenyl)-1,6-naphthyridin-5-yl]oxymethyl]pyrrolidin-2-one
CID 76687103
4-[[7-(3-methoxy-4-pentan-3-yloxyphenyl)-1,6-naphthyridin-5-yl]oxymethyl]pyrrolidin-2-one
CID 77444747
4-[[7-(4-methoxy-3-propan-2-yloxyphenyl)-1,6-naphthyridin-5-yl]oxymethyl]pyrrolidin-2-one
CID 77444763
(4R)-4-[[7-[4-(trifluoromethyl)phenyl]-1,6-naphthyridin-5-yl]oxymethyl]pyrrolidin-2-one
CID 58072029
(4R)-4-[[7-[3-methoxy-4-(oxan-4-ylmethoxy)phenyl]-1,6-naphthyridin-5-yl]oxymethyl]pyrrolidin-2-one
CID 58072091

Frequently Asked Questions

What is the IUPAC name of 4-[(7-pyridin-2-ylquinolin-5-yl)oxymethyl]pyrrolidin-2-one?
The IUPAC name of 4-[(7-pyridin-2-ylquinolin-5-yl)oxymethyl]pyrrolidin-2-one (CID 78045686) is 4-[(7-pyridin-2-ylquinolin-5-yl)oxymethyl]pyrrolidin-2-one.
What is the SMILES notation for 4-[(7-pyridin-2-ylquinolin-5-yl)oxymethyl]pyrrolidin-2-one?
The canonical SMILES for 4-[(7-pyridin-2-ylquinolin-5-yl)oxymethyl]pyrrolidin-2-one is O=C1CC(COc2cc(-c3ccccn3)cc3ncccc23)CN1.
What is the InChIKey of 4-[(7-pyridin-2-ylquinolin-5-yl)oxymethyl]pyrrolidin-2-one?
The InChIKey is QQULFUXVIPHPAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O2/c23-19-8-13(11-22-19)12-24-18-10-14(16-5-1-2-6-20-16)9-17-15(18)4-3-7-21-17/h1-7,9-10,13H,8,11-12H2,(H,22,23).
What are the key properties of 4-[(7-pyridin-2-ylquinolin-5-yl)oxymethyl]pyrrolidin-2-one?
4-[(7-pyridin-2-ylquinolin-5-yl)oxymethyl]pyrrolidin-2-one has a molecular weight of 319.36 g/mol, XLogP of 2.81, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(7-pyridin-2-ylquinolin-5-yl)oxymethyl]pyrrolidin-2-one is sourced from PubChem (CID 78045686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).