2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]-N-[(2-methylphenyl)methyl]acetamide

C26H24FN5O2 — CID 118937934

IUPAC2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]-N-[(2-methylphenyl)methyl]acetamide
SMILESCc1ccccc1CNC(=O)CN1CCN(c2cccc3c2cnn3-c2ccccc2F)C1=O
InChIInChI=1S/C26H24FN5O2/c1-18-7-2-3-8-19(18)15-28-25(33)17-30-13-14-31(26(30)34)22-11-6-12-23-20(22)16-29-32(23)24-10-5-4-9-21(24)27/h2-12,16H,13-15,17H2,1H3,(H,28,33)
InChIKeyBPVBHAMULYAQBU-UHFFFAOYSA-N
MW457.51 g/mol
LogP4.03
Rot. Bonds6

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

2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]-N-[(2-methylphenyl)methyl]acetamide (PubChem CID 118937934) has the molecular formula C26H24FN5O2 and a molecular weight of 457.51 g/mol. Its IUPAC name is 2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]-N-[(2-methylphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]-N-[(2-methylphenyl)methyl]acetamide
PubChem CID118937934
Molecular FormulaC26H24FN5O2
Molecular Weight457.51 g/mol
Exact Mass457.19
IUPAC Name2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]-N-[(2-methylphenyl)methyl]acetamide
SMILESCc1ccccc1CNC(=O)CN1CCN(c2cccc3c2cnn3-c2ccccc2F)C1=O
InChIInChI=1S/C26H24FN5O2/c1-18-7-2-3-8-19(18)15-28-25(33)17-30-13-14-31(26(30)34)22-11-6-12-23-20(22)16-29-32(23)24-10-5-4-9-21(24)27/h2-12,16H,13-15,17H2,1H3,(H,28,33)
InChIKeyBPVBHAMULYAQBU-UHFFFAOYSA-N
XLogP4.03
TPSA70.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500457.51
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]-N-[(2-methylphenyl)methyl]acetamide?
The IUPAC name of 2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]-N-[(2-methylphenyl)methyl]acetamide (CID 118937934) is 2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]-N-[(2-methylphenyl)methyl]acetamide.
What is the SMILES notation for 2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]-N-[(2-methylphenyl)methyl]acetamide?
The canonical SMILES for 2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]-N-[(2-methylphenyl)methyl]acetamide is Cc1ccccc1CNC(=O)CN1CCN(c2cccc3c2cnn3-c2ccccc2F)C1=O.
What is the InChIKey of 2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]-N-[(2-methylphenyl)methyl]acetamide?
The InChIKey is BPVBHAMULYAQBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24FN5O2/c1-18-7-2-3-8-19(18)15-28-25(33)17-30-13-14-31(26(30)34)22-11-6-12-23-20(22)16-29-32(23)24-10-5-4-9-21(24)27/h2-12,16H,13-15,17H2,1H3,(H,28,33).
What are the key properties of 2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]-N-[(2-methylphenyl)methyl]acetamide?
2-[3-[1-(2-fluorophenyl)indazol-4-yl]-2-oxoimidazolidin-1-yl]-N-[(2-methylphenyl)methyl]acetamide has a molecular weight of 457.51 g/mol, XLogP of 4.03, 6 rotatable bonds, 1 hydrogen bond donors, and 4 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-[(2-methylphenyl)methyl]acetamide is sourced from PubChem (CID 118937934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).