1-[1-(2-fluorophenyl)indazol-4-yl]-3-(1,3-oxazol-4-ylmethyl)imidazolidin-2-one

C20H16FN5O2 — CID 118937782

IUPAC1-[1-(2-fluorophenyl)indazol-4-yl]-3-(1,3-oxazol-4-ylmethyl)imidazolidin-2-one
SMILESO=C1N(Cc2cocn2)CCN1c1cccc2c1cnn2-c1ccccc1F
InChIInChI=1S/C20H16FN5O2/c21-16-4-1-2-5-19(16)26-18-7-3-6-17(15(18)10-23-26)25-9-8-24(20(25)27)11-14-12-28-13-22-14/h1-7,10,12-13H,8-9,11H2
InChIKeyKYXKKYKXKUCVDJ-UHFFFAOYSA-N
MW377.38 g/mol
LogP3.59
Rot. Bonds4

About 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(1,3-oxazol-4-ylmethyl)imidazolidin-2-one

1-[1-(2-fluorophenyl)indazol-4-yl]-3-(1,3-oxazol-4-ylmethyl)imidazolidin-2-one (PubChem CID 118937782) has the molecular formula C20H16FN5O2 and a molecular weight of 377.38 g/mol. Its IUPAC name is 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(1,3-oxazol-4-ylmethyl)imidazolidin-2-one.

Molecular Properties

Compound Name1-[1-(2-fluorophenyl)indazol-4-yl]-3-(1,3-oxazol-4-ylmethyl)imidazolidin-2-one
PubChem CID118937782
Molecular FormulaC20H16FN5O2
Molecular Weight377.38 g/mol
Exact Mass377.13
IUPAC Name1-[1-(2-fluorophenyl)indazol-4-yl]-3-(1,3-oxazol-4-ylmethyl)imidazolidin-2-one
SMILESO=C1N(Cc2cocn2)CCN1c1cccc2c1cnn2-c1ccccc1F
InChIInChI=1S/C20H16FN5O2/c21-16-4-1-2-5-19(16)26-18-7-3-6-17(15(18)10-23-26)25-9-8-24(20(25)27)11-14-12-28-13-22-14/h1-7,10,12-13H,8-9,11H2
InChIKeyKYXKKYKXKUCVDJ-UHFFFAOYSA-N
XLogP3.59
TPSA67.40 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.38
LogP ≤ 53.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(1,3-oxazol-4-ylmethyl)imidazolidin-2-one?
The IUPAC name of 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(1,3-oxazol-4-ylmethyl)imidazolidin-2-one (CID 118937782) is 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(1,3-oxazol-4-ylmethyl)imidazolidin-2-one.
What is the SMILES notation for 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(1,3-oxazol-4-ylmethyl)imidazolidin-2-one?
The canonical SMILES for 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(1,3-oxazol-4-ylmethyl)imidazolidin-2-one is O=C1N(Cc2cocn2)CCN1c1cccc2c1cnn2-c1ccccc1F.
What is the InChIKey of 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(1,3-oxazol-4-ylmethyl)imidazolidin-2-one?
The InChIKey is KYXKKYKXKUCVDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16FN5O2/c21-16-4-1-2-5-19(16)26-18-7-3-6-17(15(18)10-23-26)25-9-8-24(20(25)27)11-14-12-28-13-22-14/h1-7,10,12-13H,8-9,11H2.
What are the key properties of 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(1,3-oxazol-4-ylmethyl)imidazolidin-2-one?
1-[1-(2-fluorophenyl)indazol-4-yl]-3-(1,3-oxazol-4-ylmethyl)imidazolidin-2-one has a molecular weight of 377.38 g/mol, XLogP of 3.59, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(1,3-oxazol-4-ylmethyl)imidazolidin-2-one is sourced from PubChem (CID 118937782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).