1-(3H-benzimidazol-5-yl)-5-(2-fluorophenyl)imidazolidin-2-one

C16H13FN4O — CID 51029575

IUPAC1-(3H-benzimidazol-5-yl)-5-(2-fluorophenyl)imidazolidin-2-one
SMILESO=C1NCC(c2ccccc2F)N1c1ccc2nc[nH]c2c1
InChIInChI=1S/C16H13FN4O/c17-12-4-2-1-3-11(12)15-8-18-16(22)21(15)10-5-6-13-14(7-10)20-9-19-13/h1-7,9,15H,8H2,(H,18,22)(H,19,20)
InChIKeyDTYRPRNYDRVWAY-UHFFFAOYSA-N
MW296.31 g/mol
LogP2.97
Rot. Bonds2

About 1-(3H-benzimidazol-5-yl)-5-(2-fluorophenyl)imidazolidin-2-one

1-(3H-benzimidazol-5-yl)-5-(2-fluorophenyl)imidazolidin-2-one (PubChem CID 51029575) has the molecular formula C16H13FN4O and a molecular weight of 296.31 g/mol. Its IUPAC name is 1-(3H-benzimidazol-5-yl)-5-(2-fluorophenyl)imidazolidin-2-one.

Molecular Properties

Compound Name1-(3H-benzimidazol-5-yl)-5-(2-fluorophenyl)imidazolidin-2-one
PubChem CID51029575
Molecular FormulaC16H13FN4O
Molecular Weight296.31 g/mol
Exact Mass296.11
IUPAC Name1-(3H-benzimidazol-5-yl)-5-(2-fluorophenyl)imidazolidin-2-one
SMILESO=C1NCC(c2ccccc2F)N1c1ccc2nc[nH]c2c1
InChIInChI=1S/C16H13FN4O/c17-12-4-2-1-3-11(12)15-8-18-16(22)21(15)10-5-6-13-14(7-10)20-9-19-13/h1-7,9,15H,8H2,(H,18,22)(H,19,20)
InChIKeyDTYRPRNYDRVWAY-UHFFFAOYSA-N
XLogP2.97
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.31
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-(3H-benzimidazol-5-yl)-5-(2-fluorophenyl)imidazolidin-2-one 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 1-(3H-benzimidazol-5-yl)-5-(2-fluorophenyl)imidazolidin-2-one?
The IUPAC name of 1-(3H-benzimidazol-5-yl)-5-(2-fluorophenyl)imidazolidin-2-one (CID 51029575) is 1-(3H-benzimidazol-5-yl)-5-(2-fluorophenyl)imidazolidin-2-one.
What is the SMILES notation for 1-(3H-benzimidazol-5-yl)-5-(2-fluorophenyl)imidazolidin-2-one?
The canonical SMILES for 1-(3H-benzimidazol-5-yl)-5-(2-fluorophenyl)imidazolidin-2-one is O=C1NCC(c2ccccc2F)N1c1ccc2nc[nH]c2c1.
What is the InChIKey of 1-(3H-benzimidazol-5-yl)-5-(2-fluorophenyl)imidazolidin-2-one?
The InChIKey is DTYRPRNYDRVWAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13FN4O/c17-12-4-2-1-3-11(12)15-8-18-16(22)21(15)10-5-6-13-14(7-10)20-9-19-13/h1-7,9,15H,8H2,(H,18,22)(H,19,20).
What are the key properties of 1-(3H-benzimidazol-5-yl)-5-(2-fluorophenyl)imidazolidin-2-one?
1-(3H-benzimidazol-5-yl)-5-(2-fluorophenyl)imidazolidin-2-one has a molecular weight of 296.31 g/mol, XLogP of 2.97, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3H-benzimidazol-5-yl)-5-(2-fluorophenyl)imidazolidin-2-one is sourced from PubChem (CID 51029575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).