(4R)-4-[2-(7-quinolin-6-ylquinolin-5-yl)oxyethyl]pyrrolidin-2-one

C24H21N3O2 — CID 71240051

IUPAC(4R)-4-[2-(7-quinolin-6-ylquinolin-5-yl)oxyethyl]pyrrolidin-2-one
SMILESO=C1C[C@@H](CCOc2cc(-c3ccc4ncccc4c3)cc3ncccc23)CN1
InChIInChI=1S/C24H21N3O2/c28-24-11-16(15-27-24)7-10-29-23-14-19(13-22-20(23)4-2-9-26-22)17-5-6-21-18(12-17)3-1-8-25-21/h1-6,8-9,12-14,16H,7,10-11,15H2,(H,27,28)/t16-/m1/s1
InChIKeyAJVQBYBPFVGSAT-MRXNPFEDSA-N
MW383.45 g/mol
LogP4.36
Rot. Bonds5

About (4R)-4-[2-(7-quinolin-6-ylquinolin-5-yl)oxyethyl]pyrrolidin-2-one

(4R)-4-[2-(7-quinolin-6-ylquinolin-5-yl)oxyethyl]pyrrolidin-2-one (PubChem CID 71240051) has the molecular formula C24H21N3O2 and a molecular weight of 383.45 g/mol. Its IUPAC name is (4R)-4-[2-(7-quinolin-6-ylquinolin-5-yl)oxyethyl]pyrrolidin-2-one.

Molecular Properties

Compound Name(4R)-4-[2-(7-quinolin-6-ylquinolin-5-yl)oxyethyl]pyrrolidin-2-one
PubChem CID71240051
Molecular FormulaC24H21N3O2
Molecular Weight383.45 g/mol
Exact Mass383.16
IUPAC Name(4R)-4-[2-(7-quinolin-6-ylquinolin-5-yl)oxyethyl]pyrrolidin-2-one
SMILESO=C1C[C@@H](CCOc2cc(-c3ccc4ncccc4c3)cc3ncccc23)CN1
InChIInChI=1S/C24H21N3O2/c28-24-11-16(15-27-24)7-10-29-23-14-19(13-22-20(23)4-2-9-26-22)17-5-6-21-18(12-17)3-1-8-25-21/h1-6,8-9,12-14,16H,7,10-11,15H2,(H,27,28)/t16-/m1/s1
InChIKeyAJVQBYBPFVGSAT-MRXNPFEDSA-N
XLogP4.36
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.45
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(4S)-4-[(1R)-1-(7-quinolin-6-ylquinolin-5-yl)oxyethyl]pyrrolidin-2-one
CID 71496251
4-[[7-(3,4-dimethoxyphenyl)quinolin-5-yl]oxymethyl]pyrrolidin-2-one
CID 78045097
4-[(7-pyridin-2-ylquinolin-5-yl)oxymethyl]pyrrolidin-2-one
CID 78045686
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
4-[[7-(1-methylpyrazol-4-yl)quinolin-5-yl]oxymethyl]pyrrolidin-2-one
CID 144516403
4-[[7-[6-(oxan-4-yloxy)-3-pyridinyl]quinolin-5-yl]oxymethyl]pyrrolidin-2-one
CID 144516379
ethane;5-[[7-(3,4,5-trimethoxyphenyl)quinolin-5-yl]oxymethyl]piperidin-2-one
CID 144516320
4-[[7-(4-fluoro-3-methoxyphenyl)-1,6-naphthyridin-5-yl]oxymethyl]pyrrolidin-2-one
CID 76687103
(4R)-4-[(1R)-1-[7-[6-(methylsulfanylmethyl)-3-pyridinyl]quinolin-5-yl]oxyethyl]pyrrolidin-2-one
CID 122544044
4-[[7-(4-methoxy-3-propan-2-yloxyphenyl)-1,6-naphthyridin-5-yl]oxymethyl]pyrrolidin-2-one
CID 77444763
3-methyl-7-[5-[(1R)-1-(5-oxopyrrolidin-3-yl)ethoxy]quinolin-7-yl]quinazolin-4-one
CID 122512487

Frequently Asked Questions

What is the IUPAC name of (4R)-4-[2-(7-quinolin-6-ylquinolin-5-yl)oxyethyl]pyrrolidin-2-one?
The IUPAC name of (4R)-4-[2-(7-quinolin-6-ylquinolin-5-yl)oxyethyl]pyrrolidin-2-one (CID 71240051) is (4R)-4-[2-(7-quinolin-6-ylquinolin-5-yl)oxyethyl]pyrrolidin-2-one.
What is the SMILES notation for (4R)-4-[2-(7-quinolin-6-ylquinolin-5-yl)oxyethyl]pyrrolidin-2-one?
The canonical SMILES for (4R)-4-[2-(7-quinolin-6-ylquinolin-5-yl)oxyethyl]pyrrolidin-2-one is O=C1C[C@@H](CCOc2cc(-c3ccc4ncccc4c3)cc3ncccc23)CN1.
What is the InChIKey of (4R)-4-[2-(7-quinolin-6-ylquinolin-5-yl)oxyethyl]pyrrolidin-2-one?
The InChIKey is AJVQBYBPFVGSAT-MRXNPFEDSA-N. The full InChI is InChI=1S/C24H21N3O2/c28-24-11-16(15-27-24)7-10-29-23-14-19(13-22-20(23)4-2-9-26-22)17-5-6-21-18(12-17)3-1-8-25-21/h1-6,8-9,12-14,16H,7,10-11,15H2,(H,27,28)/t16-/m1/s1.
What are the key properties of (4R)-4-[2-(7-quinolin-6-ylquinolin-5-yl)oxyethyl]pyrrolidin-2-one?
(4R)-4-[2-(7-quinolin-6-ylquinolin-5-yl)oxyethyl]pyrrolidin-2-one has a molecular weight of 383.45 g/mol, XLogP of 4.36, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-[2-(7-quinolin-6-ylquinolin-5-yl)oxyethyl]pyrrolidin-2-one is sourced from PubChem (CID 71240051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).