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

C21H24FN3O2 — CID 3245977

IUPAC2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-[2-(4-methylphenyl)ethyl]acetamide
SMILESCc1ccc(CCNC(=O)CN2CCN(Cc3ccccc3F)C2=O)cc1
InChIInChI=1S/C21H24FN3O2/c1-16-6-8-17(9-7-16)10-11-23-20(26)15-25-13-12-24(21(25)27)14-18-4-2-3-5-19(18)22/h2-9H,10-15H2,1H3,(H,23,26)
InChIKeyKJQHZRZRIDGVEG-UHFFFAOYSA-N
MW369.44 g/mol
LogP2.73
Rot. Bonds7

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

2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-[2-(4-methylphenyl)ethyl]acetamide (PubChem CID 3245977) has the molecular formula C21H24FN3O2 and a molecular weight of 369.44 g/mol. Its IUPAC name is 2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-[2-(4-methylphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-[2-(4-methylphenyl)ethyl]acetamide
PubChem CID3245977
Molecular FormulaC21H24FN3O2
Molecular Weight369.44 g/mol
Exact Mass369.19
IUPAC Name2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-[2-(4-methylphenyl)ethyl]acetamide
SMILESCc1ccc(CCNC(=O)CN2CCN(Cc3ccccc3F)C2=O)cc1
InChIInChI=1S/C21H24FN3O2/c1-16-6-8-17(9-7-16)10-11-23-20(26)15-25-13-12-24(21(25)27)14-18-4-2-3-5-19(18)22/h2-9H,10-15H2,1H3,(H,23,26)
InChIKeyKJQHZRZRIDGVEG-UHFFFAOYSA-N
XLogP2.73
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.44
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,4-Imidazolidinedione, 3-(phenylmethyl)-
CID 231959
(5S)-3-Benzyl-5-ethyl-5-phenylimidazolidine-2,4-dione
CID 40633600
N-[1-benzyl-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]pentanamide
CID 4264496
1-[(2-Fluorophenyl)methyl]imidazolidine-2,4,5-trione
CID 2767579
Simufilam
CID 46195331
1-Pyrrolidineacetamide, N-(diphenylmethyl)-
CID 216501
3-Hexyl-5,5-diphenylimidazolidine-2,4-dione
CID 24860362
1-[1-[Oxo(1-pyrrolidinyl)methyl]cyclohexyl]-3-(phenylmethyl)urea
CID 647179
N-benzhydryl-2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)acetamide
CID 2082034
2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-[2-(4-fluorophenyl)ethyl]acetamide
CID 2087814
2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-methylacetamide
CID 2091432
2-[3-(4-Methylbenzyl)-2,4,5-trioxo-1-imidazolidinyl]acetamide
CID 2767614

Frequently Asked Questions

What is the IUPAC name of 2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-[2-(4-methylphenyl)ethyl]acetamide?
The IUPAC name of 2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-[2-(4-methylphenyl)ethyl]acetamide (CID 3245977) is 2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-[2-(4-methylphenyl)ethyl]acetamide.
What is the SMILES notation for 2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-[2-(4-methylphenyl)ethyl]acetamide?
The canonical SMILES for 2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-[2-(4-methylphenyl)ethyl]acetamide is Cc1ccc(CCNC(=O)CN2CCN(Cc3ccccc3F)C2=O)cc1.
What is the InChIKey of 2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-[2-(4-methylphenyl)ethyl]acetamide?
The InChIKey is KJQHZRZRIDGVEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24FN3O2/c1-16-6-8-17(9-7-16)10-11-23-20(26)15-25-13-12-24(21(25)27)14-18-4-2-3-5-19(18)22/h2-9H,10-15H2,1H3,(H,23,26).
What are the key properties of 2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-[2-(4-methylphenyl)ethyl]acetamide?
2-[3-[(2-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-[2-(4-methylphenyl)ethyl]acetamide has a molecular weight of 369.44 g/mol, XLogP of 2.73, 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-[2-(4-methylphenyl)ethyl]acetamide is sourced from PubChem (CID 3245977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).