1-[4-[(1,6-dimethoxy-2H-quinolin-4-yl)oxy]-3-fluorophenyl]imidazolidin-2-one

C20H20FN3O4 — CID 130421938

IUPAC1-[4-[(1,6-dimethoxy-2H-quinolin-4-yl)oxy]-3-fluorophenyl]imidazolidin-2-one
SMILESCOc1ccc2c(c1)C(Oc1ccc(N3CCNC3=O)cc1F)=CCN2OC
InChIInChI=1S/C20H20FN3O4/c1-26-14-4-5-17-15(12-14)18(7-9-24(17)27-2)28-19-6-3-13(11-16(19)21)23-10-8-22-20(23)25/h3-7,11-12H,8-10H2,1-2H3,(H,22,25)
InChIKeyRCEPBBBQZXJUML-UHFFFAOYSA-N
MW385.40 g/mol
LogP3.17
Rot. Bonds5

About 1-[4-[(1,6-dimethoxy-2H-quinolin-4-yl)oxy]-3-fluorophenyl]imidazolidin-2-one

1-[4-[(1,6-dimethoxy-2H-quinolin-4-yl)oxy]-3-fluorophenyl]imidazolidin-2-one (PubChem CID 130421938) has the molecular formula C20H20FN3O4 and a molecular weight of 385.40 g/mol. Its IUPAC name is 1-[4-[(1,6-dimethoxy-2H-quinolin-4-yl)oxy]-3-fluorophenyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[4-[(1,6-dimethoxy-2H-quinolin-4-yl)oxy]-3-fluorophenyl]imidazolidin-2-one
PubChem CID130421938
Molecular FormulaC20H20FN3O4
Molecular Weight385.40 g/mol
Exact Mass385.14
IUPAC Name1-[4-[(1,6-dimethoxy-2H-quinolin-4-yl)oxy]-3-fluorophenyl]imidazolidin-2-one
SMILESCOc1ccc2c(c1)C(Oc1ccc(N3CCNC3=O)cc1F)=CCN2OC
InChIInChI=1S/C20H20FN3O4/c1-26-14-4-5-17-15(12-14)18(7-9-24(17)27-2)28-19-6-3-13(11-16(19)21)23-10-8-22-20(23)25/h3-7,11-12H,8-10H2,1-2H3,(H,22,25)
InChIKeyRCEPBBBQZXJUML-UHFFFAOYSA-N
XLogP3.17
TPSA63.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.40
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-[4-[(1,6-dimethoxy-2H-quinolin-4-yl)oxy]-3-fluorophenyl]imidazolidin-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

Frequently Asked Questions

What is the IUPAC name of 1-[4-[(1,6-dimethoxy-2H-quinolin-4-yl)oxy]-3-fluorophenyl]imidazolidin-2-one?
The IUPAC name of 1-[4-[(1,6-dimethoxy-2H-quinolin-4-yl)oxy]-3-fluorophenyl]imidazolidin-2-one (CID 130421938) is 1-[4-[(1,6-dimethoxy-2H-quinolin-4-yl)oxy]-3-fluorophenyl]imidazolidin-2-one.
What is the SMILES notation for 1-[4-[(1,6-dimethoxy-2H-quinolin-4-yl)oxy]-3-fluorophenyl]imidazolidin-2-one?
The canonical SMILES for 1-[4-[(1,6-dimethoxy-2H-quinolin-4-yl)oxy]-3-fluorophenyl]imidazolidin-2-one is COc1ccc2c(c1)C(Oc1ccc(N3CCNC3=O)cc1F)=CCN2OC.
What is the InChIKey of 1-[4-[(1,6-dimethoxy-2H-quinolin-4-yl)oxy]-3-fluorophenyl]imidazolidin-2-one?
The InChIKey is RCEPBBBQZXJUML-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20FN3O4/c1-26-14-4-5-17-15(12-14)18(7-9-24(17)27-2)28-19-6-3-13(11-16(19)21)23-10-8-22-20(23)25/h3-7,11-12H,8-10H2,1-2H3,(H,22,25).
What are the key properties of 1-[4-[(1,6-dimethoxy-2H-quinolin-4-yl)oxy]-3-fluorophenyl]imidazolidin-2-one?
1-[4-[(1,6-dimethoxy-2H-quinolin-4-yl)oxy]-3-fluorophenyl]imidazolidin-2-one has a molecular weight of 385.40 g/mol, XLogP of 3.17, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[(1,6-dimethoxy-2H-quinolin-4-yl)oxy]-3-fluorophenyl]imidazolidin-2-one is sourced from PubChem (CID 130421938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).