(4R)-4-[(1S)-1-hydroxyethyl]-1-[(1R)-1-phenylethyl]pyrrolidin-2-one;(4R)-1-[(1R)-1-phenylethyl]-4-[(1R)-1-(7-phenylquinolin-5-yl)oxyethyl]pyrrolidin-2-one;7-phenylquinolin-5-ol;(4R)-4-[(1R)-1-(7-phenylquinolin-5-yl)oxyethyl]pyrrolidin-2-one

C79H78N6O7 — CID 158087963

IUPAC(4R)-4-[(1S)-1-hydroxyethyl]-1-[(1R)-1-phenylethyl]pyrrolidin-2-one;(4R)-1-[(1R)-1-phenylethyl]-4-[(1R)-1-(7-phenylquinolin-5-yl)oxyethyl]pyrrolidin-2-one;7-phenylquinolin-5-ol;(4R)-4-[(1R)-1-(7-phenylquinolin-5-yl)oxyethyl]pyrrolidin-2-one
SMILESC[C@@H](Oc1cc(-c2ccccc2)cc2ncccc12)[C@H]1CNC(=O)C1.C[C@H](O)[C@@H]1CC(=O)N([C@H](C)c2ccccc2)C1.C[C@H](c1ccccc1)N1C[C@H]([C@@H](C)Oc2cc(-c3ccccc3)cc3ncccc23)CC1=O.Oc1cc(-c2ccccc2)cc2ncccc12
InChIInChI=1S/C29H28N2O2.C21H20N2O2.C15H11NO.C14H19NO2/c1-20(22-10-5-3-6-11-22)31-19-25(18-29(31)32)21(2)33-28-17-24(23-12-7-4-8-13-23)16-27-26(28)14-9-15-30-27;1-14(17-12-21(24)23-13-17)25-20-11-16(15-6-3-2-4-7-15)10-19-18(20)8-5-9-22-19;17-15-10-12(11-5-2-1-3-6-11)9-14-13(15)7-4-8-16-14;1-10(12-6-4-3-5-7-12)15-9-13(11(2)16)8-14(15)17/h3-17,20-21,25H,18-19H2,1-2H3;2-11,14,17H,12-13H2,1H3,(H,23,24);1-10,17H;3-7,10-11,13,16H,8-9H2,1-2H3/t20-,21-,25-;14-,17-;;10-,11+,13-/m11.1/s1
InChIKeyFNSZGIXJYBYFEH-MQCAOOIRSA-N
MW1223.53 g/mol
LogP15.67
Rot. Bonds14

About (4R)-4-[(1S)-1-hydroxyethyl]-1-[(1R)-1-phenylethyl]pyrrolidin-2-one;(4R)-1-[(1R)-1-phenylethyl]-4-[(1R)-1-(7-phenylquinolin-5-yl)oxyethyl]pyrrolidin-2-one;7-phenylquinolin-5-ol;(4R)-4-[(1R)-1-(7-phenylquinolin-5-yl)oxyethyl]pyrrolidin-2-one

(4R)-4-[(1S)-1-hydroxyethyl]-1-[(1R)-1-phenylethyl]pyrrolidin-2-one;(4R)-1-[(1R)-1-phenylethyl]-4-[(1R)-1-(7-phenylquinolin-5-yl)oxyethyl]pyrrolidin-2-one;7-phenylquinolin-5-ol;(4R)-4-[(1R)-1-(7-phenylquinolin-5-yl)oxyethyl]pyrrolidin-2-one (PubChem CID 158087963) has the molecular formula C79H78N6O7 and a molecular weight of 1223.53 g/mol. Its IUPAC name is (4R)-4-[(1S)-1-hydroxyethyl]-1-[(1R)-1-phenylethyl]pyrrolidin-2-one;(4R)-1-[(1R)-1-phenylethyl]-4-[(1R)-1-(7-phenylquinolin-5-yl)oxyethyl]pyrrolidin-2-one;7-phenylquinolin-5-ol;(4R)-4-[(1R)-1-(7-phenylquinolin-5-yl)oxyethyl]pyrrolidin-2-one.

Molecular Properties

Compound Name(4R)-4-[(1S)-1-hydroxyethyl]-1-[(1R)-1-phenylethyl]pyrrolidin-2-one;(4R)-1-[(1R)-1-phenylethyl]-4-[(1R)-1-(7-phenylquinolin-5-yl)oxyethyl]pyrrolidin-2-one;7-phenylquinolin-5-ol;(4R)-4-[(1R)-1-(7-phenylquinolin-5-yl)oxyethyl]pyrrolidin-2-one
PubChem CID158087963
Molecular FormulaC79H78N6O7
Molecular Weight1223.53 g/mol
Exact Mass1222.59
IUPAC Name(4R)-4-[(1S)-1-hydroxyethyl]-1-[(1R)-1-phenylethyl]pyrrolidin-2-one;(4R)-1-[(1R)-1-phenylethyl]-4-[(1R)-1-(7-phenylquinolin-5-yl)oxyethyl]pyrrolidin-2-one;7-phenylquinolin-5-ol;(4R)-4-[(1R)-1-(7-phenylquinolin-5-yl)oxyethyl]pyrrolidin-2-one
SMILESC[C@@H](Oc1cc(-c2ccccc2)cc2ncccc12)[C@H]1CNC(=O)C1.C[C@H](O)[C@@H]1CC(=O)N([C@H](C)c2ccccc2)C1.C[C@H](c1ccccc1)N1C[C@H]([C@@H](C)Oc2cc(-c3ccccc3)cc3ncccc23)CC1=O.Oc1cc(-c2ccccc2)cc2ncccc12
InChIInChI=1S/C29H28N2O2.C21H20N2O2.C15H11NO.C14H19NO2/c1-20(22-10-5-3-6-11-22)31-19-25(18-29(31)32)21(2)33-28-17-24(23-12-7-4-8-13-23)16-27-26(28)14-9-15-30-27;1-14(17-12-21(24)23-13-17)25-20-11-16(15-6-3-2-4-7-15)10-19-18(20)8-5-9-22-19;17-15-10-12(11-5-2-1-3-6-11)9-14-13(15)7-4-8-16-14;1-10(12-6-4-3-5-7-12)15-9-13(11(2)16)8-14(15)17/h3-17,20-21,25H,18-19H2,1-2H3;2-11,14,17H,12-13H2,1H3,(H,23,24);1-10,17H;3-7,10-11,13,16H,8-9H2,1-2H3/t20-,21-,25-;14-,17-;;10-,11+,13-/m11.1/s1
InChIKeyFNSZGIXJYBYFEH-MQCAOOIRSA-N
XLogP15.67
TPSA167.31 Ų
H-Bond Donors3
H-Bond Acceptors10
Rotatable Bonds14
Heavy Atoms92
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001223.53
LogP ≤ 515.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1010

Analyze (4R)-4-[(1S)-1-hydroxyethyl]-1-[(1R)-1-phenylethyl]pyrrolidin-2-one;(4R)-1-[(1R)-1-phenylethyl]-4-[(1R)-1-(7-phenylquinolin-5-yl)oxyethyl]pyrrolidin-2-one;7-phenylquinolin-5-ol;(4R)-4-[(1R)-1-(7-phenylquinolin-5-yl)oxyethyl]pyrrolidin-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

Related Compounds

(R)-4-{(R)-1-[7-(5-Trifluoromethyl-pyridin-2-yl)-quinolin-5-yloxy]-ethyl}-pyrrolidin-2-one
CID 71237760
(4R)-4-[(1R)-1-[7-(6-methoxy-3-pyridinyl)quinolin-5-yl]oxyethyl]pyrrolidin-2-one
CID 71237900
(R)-4-((R)-1-(7-phenylquinolin-5-yloxy)ethyl)pyrrolidin-2-one
CID 71237983
(R)-4-((R)-1-(7-(1,2,3,4-tetrahydroisoquinolin-7-yl)quinolin-5-yloxy)ethyl)pyrrolidin-2-one
CID 71238155
(R)-4-((R)-1-(6,7'-biquinolin-5'-yloxy)ethyl)pyrrolidin-2-one
CID 71238173
(4R)-4-[(1R)-1-[7-[1-(2-hydroxyethyl)pyrazol-4-yl]quinolin-5-yl]oxyethyl]pyrrolidin-2-one
CID 71238417
(4R)-4-[(1R)-1-[7-(3,4-dimethoxyphenyl)quinolin-5-yl]oxyethyl]pyrrolidin-2-one
CID 71241892
(4R)-4-[(1R)-1-[7-(3-methoxy-4-propan-2-yloxyphenyl)quinolin-5-yl]oxyethyl]pyrrolidin-2-one
CID 71241896
(4R)-4-[(1R)-1-(7-quinolin-2-ylquinolin-5-yl)oxyethyl]pyrrolidin-2-one
CID 71241906
(4R)-4-[(1R)-1-[7-(2-methylquinolin-6-yl)quinolin-5-yl]oxyethyl]pyrrolidin-2-one
CID 71241907
(4R)-4-[(1R)-1-[7-(1-methylindazol-6-yl)quinolin-5-yl]oxyethyl]pyrrolidin-2-one
CID 71241911
(4R)-4-[(1R)-1-[7-[4-(morpholin-4-ylmethyl)phenyl]quinolin-5-yl]oxyethyl]pyrrolidin-2-one
CID 71241912

Frequently Asked Questions

What is the IUPAC name of (4R)-4-[(1S)-1-hydroxyethyl]-1-[(1R)-1-phenylethyl]pyrrolidin-2-one;(4R)-1-[(1R)-1-phenylethyl]-4-[(1R)-1-(7-phenylquinolin-5-yl)oxyethyl]pyrrolidin-2-one;7-phenylquinolin-5-ol;(4R)-4-[(1R)-1-(7-phenylquinolin-5-yl)oxyethyl]pyrrolidin-2-one?
The IUPAC name of (4R)-4-[(1S)-1-hydroxyethyl]-1-[(1R)-1-phenylethyl]pyrrolidin-2-one;(4R)-1-[(1R)-1-phenylethyl]-4-[(1R)-1-(7-phenylquinolin-5-yl)oxyethyl]pyrrolidin-2-one;7-phenylquinolin-5-ol;(4R)-4-[(1R)-1-(7-phenylquinolin-5-yl)oxyethyl]pyrrolidin-2-one (CID 158087963) is (4R)-4-[(1S)-1-hydroxyethyl]-1-[(1R)-1-phenylethyl]pyrrolidin-2-one;(4R)-1-[(1R)-1-phenylethyl]-4-[(1R)-1-(7-phenylquinolin-5-yl)oxyethyl]pyrrolidin-2-one;7-phenylquinolin-5-ol;(4R)-4-[(1R)-1-(7-phenylquinolin-5-yl)oxyethyl]pyrrolidin-2-one.
What is the SMILES notation for (4R)-4-[(1S)-1-hydroxyethyl]-1-[(1R)-1-phenylethyl]pyrrolidin-2-one;(4R)-1-[(1R)-1-phenylethyl]-4-[(1R)-1-(7-phenylquinolin-5-yl)oxyethyl]pyrrolidin-2-one;7-phenylquinolin-5-ol;(4R)-4-[(1R)-1-(7-phenylquinolin-5-yl)oxyethyl]pyrrolidin-2-one?
The canonical SMILES for (4R)-4-[(1S)-1-hydroxyethyl]-1-[(1R)-1-phenylethyl]pyrrolidin-2-one;(4R)-1-[(1R)-1-phenylethyl]-4-[(1R)-1-(7-phenylquinolin-5-yl)oxyethyl]pyrrolidin-2-one;7-phenylquinolin-5-ol;(4R)-4-[(1R)-1-(7-phenylquinolin-5-yl)oxyethyl]pyrrolidin-2-one is C[C@@H](Oc1cc(-c2ccccc2)cc2ncccc12)[C@H]1CNC(=O)C1.C[C@H](O)[C@@H]1CC(=O)N([C@H](C)c2ccccc2)C1.C[C@H](c1ccccc1)N1C[C@H]([C@@H](C)Oc2cc(-c3ccccc3)cc3ncccc23)CC1=O.Oc1cc(-c2ccccc2)cc2ncccc12.
What is the InChIKey of (4R)-4-[(1S)-1-hydroxyethyl]-1-[(1R)-1-phenylethyl]pyrrolidin-2-one;(4R)-1-[(1R)-1-phenylethyl]-4-[(1R)-1-(7-phenylquinolin-5-yl)oxyethyl]pyrrolidin-2-one;7-phenylquinolin-5-ol;(4R)-4-[(1R)-1-(7-phenylquinolin-5-yl)oxyethyl]pyrrolidin-2-one?
The InChIKey is FNSZGIXJYBYFEH-MQCAOOIRSA-N. The full InChI is InChI=1S/C29H28N2O2.C21H20N2O2.C15H11NO.C14H19NO2/c1-20(22-10-5-3-6-11-22)31-19-25(18-29(31)32)21(2)33-28-17-24(23-12-7-4-8-13-23)16-27-26(28)14-9-15-30-27;1-14(17-12-21(24)23-13-17)25-20-11-16(15-6-3-2-4-7-15)10-19-18(20)8-5-9-22-19;17-15-10-12(11-5-2-1-3-6-11)9-14-13(15)7-4-8-16-14;1-10(12-6-4-3-5-7-12)15-9-13(11(2)16)8-14(15)17/h3-17,20-21,25H,18-19H2,1-2H3;2-11,14,17H,12-13H2,1H3,(H,23,24);1-10,17H;3-7,10-11,13,16H,8-9H2,1-2H3/t20-,21-,25-;14-,17-;;10-,11+,13-/m11.1/s1.
What are the key properties of (4R)-4-[(1S)-1-hydroxyethyl]-1-[(1R)-1-phenylethyl]pyrrolidin-2-one;(4R)-1-[(1R)-1-phenylethyl]-4-[(1R)-1-(7-phenylquinolin-5-yl)oxyethyl]pyrrolidin-2-one;7-phenylquinolin-5-ol;(4R)-4-[(1R)-1-(7-phenylquinolin-5-yl)oxyethyl]pyrrolidin-2-one?
(4R)-4-[(1S)-1-hydroxyethyl]-1-[(1R)-1-phenylethyl]pyrrolidin-2-one;(4R)-1-[(1R)-1-phenylethyl]-4-[(1R)-1-(7-phenylquinolin-5-yl)oxyethyl]pyrrolidin-2-one;7-phenylquinolin-5-ol;(4R)-4-[(1R)-1-(7-phenylquinolin-5-yl)oxyethyl]pyrrolidin-2-one has a molecular weight of 1223.53 g/mol, XLogP of 15.67, 14 rotatable bonds, 3 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-[(1S)-1-hydroxyethyl]-1-[(1R)-1-phenylethyl]pyrrolidin-2-one;(4R)-1-[(1R)-1-phenylethyl]-4-[(1R)-1-(7-phenylquinolin-5-yl)oxyethyl]pyrrolidin-2-one;7-phenylquinolin-5-ol;(4R)-4-[(1R)-1-(7-phenylquinolin-5-yl)oxyethyl]pyrrolidin-2-one is sourced from PubChem (CID 158087963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).