5-hydroxy-1-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-3-(3-methoxyphenyl)pyrrolidin-2-one

C21H20N2O5 — CID 118239067

IUPAC5-hydroxy-1-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-3-(3-methoxyphenyl)pyrrolidin-2-one
SMILESCOc1cccc(C2CC(O)N(c3ccc(-c4cnco4)c(OC)c3)C2=O)c1
InChIInChI=1S/C21H20N2O5/c1-26-15-5-3-4-13(8-15)17-10-20(24)23(21(17)25)14-6-7-16(18(9-14)27-2)19-11-22-12-28-19/h3-9,11-12,17,20,24H,10H2,1-2H3
InChIKeyUKUKTYXCPCFGCN-UHFFFAOYSA-N
MW380.40 g/mol
LogP3.20
Rot. Bonds5

About 5-hydroxy-1-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-3-(3-methoxyphenyl)pyrrolidin-2-one

5-hydroxy-1-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-3-(3-methoxyphenyl)pyrrolidin-2-one (PubChem CID 118239067) has the molecular formula C21H20N2O5 and a molecular weight of 380.40 g/mol. Its IUPAC name is 5-hydroxy-1-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-3-(3-methoxyphenyl)pyrrolidin-2-one.

Molecular Properties

Compound Name5-hydroxy-1-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-3-(3-methoxyphenyl)pyrrolidin-2-one
PubChem CID118239067
Molecular FormulaC21H20N2O5
Molecular Weight380.40 g/mol
Exact Mass380.14
IUPAC Name5-hydroxy-1-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-3-(3-methoxyphenyl)pyrrolidin-2-one
SMILESCOc1cccc(C2CC(O)N(c3ccc(-c4cnco4)c(OC)c3)C2=O)c1
InChIInChI=1S/C21H20N2O5/c1-26-15-5-3-4-13(8-15)17-10-20(24)23(21(17)25)14-6-7-16(18(9-14)27-2)19-11-22-12-28-19/h3-9,11-12,17,20,24H,10H2,1-2H3
InChIKeyUKUKTYXCPCFGCN-UHFFFAOYSA-N
XLogP3.20
TPSA85.03 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.40
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5-hydroxy-1-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-3-(3-methoxyphenyl)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

(3R)-3-(2-fluorophenyl)-1-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]pyrrolidin-2-one
CID 125488963
3-(2-chlorophenyl)-1-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]pyrrolidin-2-one
CID 118239082
1-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-3-(2-methoxyphenyl)pyrrolidin-2-one;3-[(3-methoxyphenyl)methyl]-1-[3-methoxy-4-(1H-pyrazol-4-yl)phenyl]pyrrolidin-2-one
CID 118239100
3-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-5-(2-methoxyphenyl)-4-methyl-2H-1,3-oxazol-2-amine
CID 67046578
2-(3-hydroxy-6-methoxy-2,3-dihydro-1H-inden-1-yl)-N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]acetamide
CID 123444013
3-methoxy-4-(1,3-oxazol-5-yl)benzoic acid
CID 23577995
ethane;5-(2-methoxy-4-methylphenyl)-1,3-oxazole
CID 143041662
(3S)-3-(3-methoxyphenyl)oxolane-2,5-dione
CID 98232209
(3S)-3-(3-methoxyphenyl)-1-(4-pyridin-4-ylphenyl)pyrrolidin-2-one
CID 125488307
(3R)-3-(3-methoxyphenyl)-1-methylpyrrolidine-2,5-dione
CID 53466595
(1R,4R,5R)-2,5-bis(3-methoxyphenyl)-2-azabicyclo[2.2.1]heptan-3-one
CID 46850496
N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-N'-[4-(3-methoxyphenoxy)-2-methylbutan-2-yl]oxamide
CID 20766863

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-1-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-3-(3-methoxyphenyl)pyrrolidin-2-one?
The IUPAC name of 5-hydroxy-1-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-3-(3-methoxyphenyl)pyrrolidin-2-one (CID 118239067) is 5-hydroxy-1-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-3-(3-methoxyphenyl)pyrrolidin-2-one.
What is the SMILES notation for 5-hydroxy-1-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-3-(3-methoxyphenyl)pyrrolidin-2-one?
The canonical SMILES for 5-hydroxy-1-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-3-(3-methoxyphenyl)pyrrolidin-2-one is COc1cccc(C2CC(O)N(c3ccc(-c4cnco4)c(OC)c3)C2=O)c1.
What is the InChIKey of 5-hydroxy-1-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-3-(3-methoxyphenyl)pyrrolidin-2-one?
The InChIKey is UKUKTYXCPCFGCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O5/c1-26-15-5-3-4-13(8-15)17-10-20(24)23(21(17)25)14-6-7-16(18(9-14)27-2)19-11-22-12-28-19/h3-9,11-12,17,20,24H,10H2,1-2H3.
What are the key properties of 5-hydroxy-1-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-3-(3-methoxyphenyl)pyrrolidin-2-one?
5-hydroxy-1-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-3-(3-methoxyphenyl)pyrrolidin-2-one has a molecular weight of 380.40 g/mol, XLogP of 3.20, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-1-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-3-(3-methoxyphenyl)pyrrolidin-2-one is sourced from PubChem (CID 118239067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).