2-(3-fluorophenoxy)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide

C15H12FN3O3 — CID 2430049

IUPAC2-(3-fluorophenoxy)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide
SMILESO=C(COc1cccc(F)c1)Nc1ccc2[nH]c(=O)[nH]c2c1
InChIInChI=1S/C15H12FN3O3/c16-9-2-1-3-11(6-9)22-8-14(20)17-10-4-5-12-13(7-10)19-15(21)18-12/h1-7H,8H2,(H,17,20)(H2,18,19,21)
InChIKeyCYDMXFYQNZXIBI-UHFFFAOYSA-N
MW301.28 g/mol
LogP2.01
Rot. Bonds4

About 2-(3-fluorophenoxy)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide

2-(3-fluorophenoxy)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide (PubChem CID 2430049) has the molecular formula C15H12FN3O3 and a molecular weight of 301.28 g/mol. Its IUPAC name is 2-(3-fluorophenoxy)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide.

Molecular Properties

Compound Name2-(3-fluorophenoxy)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide
PubChem CID2430049
Molecular FormulaC15H12FN3O3
Molecular Weight301.28 g/mol
Exact Mass301.09
IUPAC Name2-(3-fluorophenoxy)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide
SMILESO=C(COc1cccc(F)c1)Nc1ccc2[nH]c(=O)[nH]c2c1
InChIInChI=1S/C15H12FN3O3/c16-9-2-1-3-11(6-9)22-8-14(20)17-10-4-5-12-13(7-10)19-15(21)18-12/h1-7H,8H2,(H,17,20)(H2,18,19,21)
InChIKeyCYDMXFYQNZXIBI-UHFFFAOYSA-N
XLogP2.01
TPSA86.98 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.28
LogP ≤ 52.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenoxy)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide?
The IUPAC name of 2-(3-fluorophenoxy)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide (CID 2430049) is 2-(3-fluorophenoxy)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide.
What is the SMILES notation for 2-(3-fluorophenoxy)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide?
The canonical SMILES for 2-(3-fluorophenoxy)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide is O=C(COc1cccc(F)c1)Nc1ccc2[nH]c(=O)[nH]c2c1.
What is the InChIKey of 2-(3-fluorophenoxy)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide?
The InChIKey is CYDMXFYQNZXIBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12FN3O3/c16-9-2-1-3-11(6-9)22-8-14(20)17-10-4-5-12-13(7-10)19-15(21)18-12/h1-7H,8H2,(H,17,20)(H2,18,19,21).
What are the key properties of 2-(3-fluorophenoxy)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide?
2-(3-fluorophenoxy)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide has a molecular weight of 301.28 g/mol, XLogP of 2.01, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenoxy)-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide is sourced from PubChem (CID 2430049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).