1-[1-(2-fluorophenyl)indazol-4-yl]-3-pyridin-4-ylimidazolidin-2-one

C21H16FN5O — CID 118937702

IUPAC1-[1-(2-fluorophenyl)indazol-4-yl]-3-pyridin-4-ylimidazolidin-2-one
SMILESO=C1N(c2ccncc2)CCN1c1cccc2c1cnn2-c1ccccc1F
InChIInChI=1S/C21H16FN5O/c22-17-4-1-2-5-20(17)27-19-7-3-6-18(16(19)14-24-27)26-13-12-25(21(26)28)15-8-10-23-11-9-15/h1-11,14H,12-13H2
InChIKeyRPGAGCSEOOCHRH-UHFFFAOYSA-N
MW373.39 g/mol
LogP4.01
Rot. Bonds3

About 1-[1-(2-fluorophenyl)indazol-4-yl]-3-pyridin-4-ylimidazolidin-2-one

1-[1-(2-fluorophenyl)indazol-4-yl]-3-pyridin-4-ylimidazolidin-2-one (PubChem CID 118937702) has the molecular formula C21H16FN5O and a molecular weight of 373.39 g/mol. Its IUPAC name is 1-[1-(2-fluorophenyl)indazol-4-yl]-3-pyridin-4-ylimidazolidin-2-one.

Molecular Properties

Compound Name1-[1-(2-fluorophenyl)indazol-4-yl]-3-pyridin-4-ylimidazolidin-2-one
PubChem CID118937702
Molecular FormulaC21H16FN5O
Molecular Weight373.39 g/mol
Exact Mass373.13
IUPAC Name1-[1-(2-fluorophenyl)indazol-4-yl]-3-pyridin-4-ylimidazolidin-2-one
SMILESO=C1N(c2ccncc2)CCN1c1cccc2c1cnn2-c1ccccc1F
InChIInChI=1S/C21H16FN5O/c22-17-4-1-2-5-20(17)27-19-7-3-6-18(16(19)14-24-27)26-13-12-25(21(26)28)15-8-10-23-11-9-15/h1-11,14H,12-13H2
InChIKeyRPGAGCSEOOCHRH-UHFFFAOYSA-N
XLogP4.01
TPSA54.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.39
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(2-fluorophenyl)indazol-4-yl]-3-pyridin-4-ylimidazolidin-2-one?
The IUPAC name of 1-[1-(2-fluorophenyl)indazol-4-yl]-3-pyridin-4-ylimidazolidin-2-one (CID 118937702) is 1-[1-(2-fluorophenyl)indazol-4-yl]-3-pyridin-4-ylimidazolidin-2-one.
What is the SMILES notation for 1-[1-(2-fluorophenyl)indazol-4-yl]-3-pyridin-4-ylimidazolidin-2-one?
The canonical SMILES for 1-[1-(2-fluorophenyl)indazol-4-yl]-3-pyridin-4-ylimidazolidin-2-one is O=C1N(c2ccncc2)CCN1c1cccc2c1cnn2-c1ccccc1F.
What is the InChIKey of 1-[1-(2-fluorophenyl)indazol-4-yl]-3-pyridin-4-ylimidazolidin-2-one?
The InChIKey is RPGAGCSEOOCHRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16FN5O/c22-17-4-1-2-5-20(17)27-19-7-3-6-18(16(19)14-24-27)26-13-12-25(21(26)28)15-8-10-23-11-9-15/h1-11,14H,12-13H2.
What are the key properties of 1-[1-(2-fluorophenyl)indazol-4-yl]-3-pyridin-4-ylimidazolidin-2-one?
1-[1-(2-fluorophenyl)indazol-4-yl]-3-pyridin-4-ylimidazolidin-2-one has a molecular weight of 373.39 g/mol, XLogP of 4.01, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2-fluorophenyl)indazol-4-yl]-3-pyridin-4-ylimidazolidin-2-one is sourced from PubChem (CID 118937702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).