N-(4-fluorophenyl)-6-(5-methyl-2-oxoimidazolidin-4-yl)hexanamide

C16H22FN3O2 — CID 4916634

IUPACN-(4-fluorophenyl)-6-(5-methyl-2-oxoimidazolidin-4-yl)hexanamide
SMILESCC1NC(=O)NC1CCCCCC(=O)Nc1ccc(F)cc1
InChIInChI=1S/C16H22FN3O2/c1-11-14(20-16(22)18-11)5-3-2-4-6-15(21)19-13-9-7-12(17)8-10-13/h7-11,14H,2-6H2,1H3,(H,19,21)(H2,18,20,22)
InChIKeyDITRHERLQQIVDS-UHFFFAOYSA-N
MW307.37 g/mol
LogP2.78
Rot. Bonds7

About N-(4-fluorophenyl)-6-(5-methyl-2-oxoimidazolidin-4-yl)hexanamide

N-(4-fluorophenyl)-6-(5-methyl-2-oxoimidazolidin-4-yl)hexanamide (PubChem CID 4916634) has the molecular formula C16H22FN3O2 and a molecular weight of 307.37 g/mol. Its IUPAC name is N-(4-fluorophenyl)-6-(5-methyl-2-oxoimidazolidin-4-yl)hexanamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-6-(5-methyl-2-oxoimidazolidin-4-yl)hexanamide
PubChem CID4916634
Molecular FormulaC16H22FN3O2
Molecular Weight307.37 g/mol
Exact Mass307.17
IUPAC NameN-(4-fluorophenyl)-6-(5-methyl-2-oxoimidazolidin-4-yl)hexanamide
SMILESCC1NC(=O)NC1CCCCCC(=O)Nc1ccc(F)cc1
InChIInChI=1S/C16H22FN3O2/c1-11-14(20-16(22)18-11)5-3-2-4-6-15(21)19-13-9-7-12(17)8-10-13/h7-11,14H,2-6H2,1H3,(H,19,21)(H2,18,20,22)
InChIKeyDITRHERLQQIVDS-UHFFFAOYSA-N
XLogP2.78
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.37
LogP ≤ 52.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(3-ethylphenyl)-6-(5-methyl-2-oxoimidazolidin-4-yl)hexanamide
CID 4916632
5-Methyl-3-phenylimidazolidine-2,4-dione
CID 5146782
(2S,3S)-3-(4-acetamidophenyl)-1-[(3S)-3-fluoropyrrolidin-1-yl]-1-oxobutan-2-aminium
CID 23647706
N-(2-(4-(2,3-Dihydro-2-oxo-1H-benzimidazol-1-yl)-1-piperidinyl)ethyl)octanamide
CID 25105696
N-(2-(4-(2-Oxo-2,3-dihydro-1H-benzo[d]imidazol-1-yl)piperidin-1-yl)ethyl)palmitamide
CID 25105697
2-(2,4-dioxo-1,3-diazaspiro[4.5]dec-3-yl)-N-(4-fluorophenyl)acetamide
CID 2078174
2-[4-methyl-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]-N-(2,3,4-trifluorophenyl)acetamide
CID 3909305
N-(3-fluorophenyl)-2-[methyl-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)amino]acetamide
CID 4881886
N-(3-fluoro-2-methylphenyl)-6-(5-methyl-2-oxoimidazolidin-4-yl)hexanamide
CID 4918562
N-(2,6-dimethylphenyl)-6-(5-methyl-2-oxoimidazolidin-4-yl)hexanamide
CID 4918593
N-(3-chloro-4-fluorophenyl)-6-(5-methyl-2-oxoimidazolidin-4-yl)hexanamide
CID 4976766
N-(4-fluorophenyl)-2-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)amino]acetamide
CID 9116461

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-6-(5-methyl-2-oxoimidazolidin-4-yl)hexanamide?
The IUPAC name of N-(4-fluorophenyl)-6-(5-methyl-2-oxoimidazolidin-4-yl)hexanamide (CID 4916634) is N-(4-fluorophenyl)-6-(5-methyl-2-oxoimidazolidin-4-yl)hexanamide.
What is the SMILES notation for N-(4-fluorophenyl)-6-(5-methyl-2-oxoimidazolidin-4-yl)hexanamide?
The canonical SMILES for N-(4-fluorophenyl)-6-(5-methyl-2-oxoimidazolidin-4-yl)hexanamide is CC1NC(=O)NC1CCCCCC(=O)Nc1ccc(F)cc1.
What is the InChIKey of N-(4-fluorophenyl)-6-(5-methyl-2-oxoimidazolidin-4-yl)hexanamide?
The InChIKey is DITRHERLQQIVDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22FN3O2/c1-11-14(20-16(22)18-11)5-3-2-4-6-15(21)19-13-9-7-12(17)8-10-13/h7-11,14H,2-6H2,1H3,(H,19,21)(H2,18,20,22).
What are the key properties of N-(4-fluorophenyl)-6-(5-methyl-2-oxoimidazolidin-4-yl)hexanamide?
N-(4-fluorophenyl)-6-(5-methyl-2-oxoimidazolidin-4-yl)hexanamide has a molecular weight of 307.37 g/mol, XLogP of 2.78, 7 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-6-(5-methyl-2-oxoimidazolidin-4-yl)hexanamide is sourced from PubChem (CID 4916634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).