2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-(3-methylbutyl)acetamide

C17H24FN3O2 — CID 4090746

IUPAC2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-(3-methylbutyl)acetamide
SMILESCC(C)CCNC(=O)CN1CCN(Cc2ccccc2F)C1=O
InChIInChI=1S/C17H24FN3O2/c1-13(2)7-8-19-16(22)12-21-10-9-20(17(21)23)11-14-5-3-4-6-15(14)18/h3-6,13H,7-12H2,1-2H3,(H,19,22)
InChIKeyLJPSWQDXZNKZDQ-UHFFFAOYSA-N
MW321.40 g/mol
LogP2.23
Rot. Bonds7

About 2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-(3-methylbutyl)acetamide

2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-(3-methylbutyl)acetamide (PubChem CID 4090746) has the molecular formula C17H24FN3O2 and a molecular weight of 321.40 g/mol. Its IUPAC name is 2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-(3-methylbutyl)acetamide.

Molecular Properties

Compound Name2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-(3-methylbutyl)acetamide
PubChem CID4090746
Molecular FormulaC17H24FN3O2
Molecular Weight321.40 g/mol
Exact Mass321.19
IUPAC Name2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-(3-methylbutyl)acetamide
SMILESCC(C)CCNC(=O)CN1CCN(Cc2ccccc2F)C1=O
InChIInChI=1S/C17H24FN3O2/c1-13(2)7-8-19-16(22)12-21-10-9-20(17(21)23)11-14-5-3-4-6-15(14)18/h3-6,13H,7-12H2,1-2H3,(H,19,22)
InChIKeyLJPSWQDXZNKZDQ-UHFFFAOYSA-N
XLogP2.23
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.40
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-(3-methylbutyl)acetamide?
The IUPAC name of 2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-(3-methylbutyl)acetamide (CID 4090746) is 2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-(3-methylbutyl)acetamide.
What is the SMILES notation for 2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-(3-methylbutyl)acetamide?
The canonical SMILES for 2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-(3-methylbutyl)acetamide is CC(C)CCNC(=O)CN1CCN(Cc2ccccc2F)C1=O.
What is the InChIKey of 2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-(3-methylbutyl)acetamide?
The InChIKey is LJPSWQDXZNKZDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24FN3O2/c1-13(2)7-8-19-16(22)12-21-10-9-20(17(21)23)11-14-5-3-4-6-15(14)18/h3-6,13H,7-12H2,1-2H3,(H,19,22).
What are the key properties of 2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-(3-methylbutyl)acetamide?
2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-(3-methylbutyl)acetamide has a molecular weight of 321.40 g/mol, XLogP of 2.23, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-(3-methylbutyl)acetamide is sourced from PubChem (CID 4090746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).