1-[1-(2-fluorophenyl)indazol-4-yl]-3-(2-phenylethyl)imidazolidin-2-one

C24H21FN4O — CID 118937841

IUPAC1-[1-(2-fluorophenyl)indazol-4-yl]-3-(2-phenylethyl)imidazolidin-2-one
SMILESO=C1N(CCc2ccccc2)CCN1c1cccc2c1cnn2-c1ccccc1F
InChIInChI=1S/C24H21FN4O/c25-20-9-4-5-10-23(20)29-22-12-6-11-21(19(22)17-26-29)28-16-15-27(24(28)30)14-13-18-7-2-1-3-8-18/h1-12,17H,13-16H2
InChIKeyXVZJNJWRVFPUPI-UHFFFAOYSA-N
MW400.46 g/mol
LogP4.65
Rot. Bonds5

About 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(2-phenylethyl)imidazolidin-2-one

1-[1-(2-fluorophenyl)indazol-4-yl]-3-(2-phenylethyl)imidazolidin-2-one (PubChem CID 118937841) has the molecular formula C24H21FN4O and a molecular weight of 400.46 g/mol. Its IUPAC name is 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(2-phenylethyl)imidazolidin-2-one.

Molecular Properties

Compound Name1-[1-(2-fluorophenyl)indazol-4-yl]-3-(2-phenylethyl)imidazolidin-2-one
PubChem CID118937841
Molecular FormulaC24H21FN4O
Molecular Weight400.46 g/mol
Exact Mass400.17
IUPAC Name1-[1-(2-fluorophenyl)indazol-4-yl]-3-(2-phenylethyl)imidazolidin-2-one
SMILESO=C1N(CCc2ccccc2)CCN1c1cccc2c1cnn2-c1ccccc1F
InChIInChI=1S/C24H21FN4O/c25-20-9-4-5-10-23(20)29-22-12-6-11-21(19(22)17-26-29)28-16-15-27(24(28)30)14-13-18-7-2-1-3-8-18/h1-12,17H,13-16H2
InChIKeyXVZJNJWRVFPUPI-UHFFFAOYSA-N
XLogP4.65
TPSA41.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.46
LogP ≤ 54.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(2-phenylethyl)imidazolidin-2-one?
The IUPAC name of 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(2-phenylethyl)imidazolidin-2-one (CID 118937841) is 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(2-phenylethyl)imidazolidin-2-one.
What is the SMILES notation for 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(2-phenylethyl)imidazolidin-2-one?
The canonical SMILES for 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(2-phenylethyl)imidazolidin-2-one is O=C1N(CCc2ccccc2)CCN1c1cccc2c1cnn2-c1ccccc1F.
What is the InChIKey of 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(2-phenylethyl)imidazolidin-2-one?
The InChIKey is XVZJNJWRVFPUPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21FN4O/c25-20-9-4-5-10-23(20)29-22-12-6-11-21(19(22)17-26-29)28-16-15-27(24(28)30)14-13-18-7-2-1-3-8-18/h1-12,17H,13-16H2.
What are the key properties of 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(2-phenylethyl)imidazolidin-2-one?
1-[1-(2-fluorophenyl)indazol-4-yl]-3-(2-phenylethyl)imidazolidin-2-one has a molecular weight of 400.46 g/mol, XLogP of 4.65, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(2-phenylethyl)imidazolidin-2-one is sourced from PubChem (CID 118937841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).