2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]-N-[(3R)-oxolan-3-yl]acetamide

C22H22FN5O3 — CID 118937603

IUPAC2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]-N-[(3R)-oxolan-3-yl]acetamide
SMILESO=C(CN1CCN(c2cccc3c2cnn3-c2ccccc2F)C1=O)N[C@@H]1CCOC1
InChIInChI=1S/C22H22FN5O3/c23-17-4-1-2-5-20(17)28-19-7-3-6-18(16(19)12-24-28)27-10-9-26(22(27)30)13-21(29)25-15-8-11-31-14-15/h1-7,12,15H,8-11,13-14H2,(H,25,29)/t15-/m1/s1
InChIKeyROCRDDYVKPYLHQ-OAHLLOKOSA-N
MW423.45 g/mol
LogP2.31
Rot. Bonds5

About 2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]-N-[(3R)-oxolan-3-yl]acetamide

2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]-N-[(3R)-oxolan-3-yl]acetamide (PubChem CID 118937603) has the molecular formula C22H22FN5O3 and a molecular weight of 423.45 g/mol. Its IUPAC name is 2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]-N-[(3R)-oxolan-3-yl]acetamide.

Molecular Properties

Compound Name2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]-N-[(3R)-oxolan-3-yl]acetamide
PubChem CID118937603
Molecular FormulaC22H22FN5O3
Molecular Weight423.45 g/mol
Exact Mass423.17
IUPAC Name2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]-N-[(3R)-oxolan-3-yl]acetamide
SMILESO=C(CN1CCN(c2cccc3c2cnn3-c2ccccc2F)C1=O)N[C@@H]1CCOC1
InChIInChI=1S/C22H22FN5O3/c23-17-4-1-2-5-20(17)28-19-7-3-6-18(16(19)12-24-28)27-10-9-26(22(27)30)13-21(29)25-15-8-11-31-14-15/h1-7,12,15H,8-11,13-14H2,(H,25,29)/t15-/m1/s1
InChIKeyROCRDDYVKPYLHQ-OAHLLOKOSA-N
XLogP2.31
TPSA79.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500423.45
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]-N-[(3R)-oxolan-3-yl]acetamide 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 2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]-N-[(3R)-oxolan-3-yl]acetamide?
The IUPAC name of 2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]-N-[(3R)-oxolan-3-yl]acetamide (CID 118937603) is 2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]-N-[(3R)-oxolan-3-yl]acetamide.
What is the SMILES notation for 2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]-N-[(3R)-oxolan-3-yl]acetamide?
The canonical SMILES for 2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]-N-[(3R)-oxolan-3-yl]acetamide is O=C(CN1CCN(c2cccc3c2cnn3-c2ccccc2F)C1=O)N[C@@H]1CCOC1.
What is the InChIKey of 2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]-N-[(3R)-oxolan-3-yl]acetamide?
The InChIKey is ROCRDDYVKPYLHQ-OAHLLOKOSA-N. The full InChI is InChI=1S/C22H22FN5O3/c23-17-4-1-2-5-20(17)28-19-7-3-6-18(16(19)12-24-28)27-10-9-26(22(27)30)13-21(29)25-15-8-11-31-14-15/h1-7,12,15H,8-11,13-14H2,(H,25,29)/t15-/m1/s1.
What are the key properties of 2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]-N-[(3R)-oxolan-3-yl]acetamide?
2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]-N-[(3R)-oxolan-3-yl]acetamide has a molecular weight of 423.45 g/mol, XLogP of 2.31, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]-N-[(3R)-oxolan-3-yl]acetamide is sourced from PubChem (CID 118937603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).