N-benzyl-N-(1-cyclopropylethyl)-2-[4-(2,5-dimethylfuran-3-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide

C24H29N3O4 — CID 60620285

IUPACN-benzyl-N-(1-cyclopropylethyl)-2-[4-(2,5-dimethylfuran-3-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
SMILESCc1cc(C2(C)NC(=O)N(CC(=O)N(Cc3ccccc3)C(C)C3CC3)C2=O)c(C)o1
InChIInChI=1S/C24H29N3O4/c1-15-12-20(17(3)31-15)24(4)22(29)27(23(30)25-24)14-21(28)26(16(2)19-10-11-19)13-18-8-6-5-7-9-18/h5-9,12,16,19H,10-11,13-14H2,1-4H3,(H,25,30)
InChIKeyCUFRJQFXSIWVLK-UHFFFAOYSA-N
MW423.51 g/mol
LogP3.49
Rot. Bonds7

About N-benzyl-N-(1-cyclopropylethyl)-2-[4-(2,5-dimethylfuran-3-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide

N-benzyl-N-(1-cyclopropylethyl)-2-[4-(2,5-dimethylfuran-3-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide (PubChem CID 60620285) has the molecular formula C24H29N3O4 and a molecular weight of 423.51 g/mol. Its IUPAC name is N-benzyl-N-(1-cyclopropylethyl)-2-[4-(2,5-dimethylfuran-3-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide.

Molecular Properties

Compound NameN-benzyl-N-(1-cyclopropylethyl)-2-[4-(2,5-dimethylfuran-3-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
PubChem CID60620285
Molecular FormulaC24H29N3O4
Molecular Weight423.51 g/mol
Exact Mass423.22
IUPAC NameN-benzyl-N-(1-cyclopropylethyl)-2-[4-(2,5-dimethylfuran-3-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
SMILESCc1cc(C2(C)NC(=O)N(CC(=O)N(Cc3ccccc3)C(C)C3CC3)C2=O)c(C)o1
InChIInChI=1S/C24H29N3O4/c1-15-12-20(17(3)31-15)24(4)22(29)27(23(30)25-24)14-21(28)26(16(2)19-10-11-19)13-18-8-6-5-7-9-18/h5-9,12,16,19H,10-11,13-14H2,1-4H3,(H,25,30)
InChIKeyCUFRJQFXSIWVLK-UHFFFAOYSA-N
XLogP3.49
TPSA82.86 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500423.51
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-benzyl-N-(1-cyclopropylethyl)-2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)acetamide
CID 55399926
N-benzyl-N-[(1R)-1-cyclopropylethyl]-2-[(4S)-4-[4-(difluoromethoxy)phenyl]-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 51923998
N-benzyl-N-(1-cyclopropylethyl)-2-[6-(hydroxymethyl)-2',5'-dioxospiro[1,2-dihydroindene-3,4'-imidazolidine]-1'-yl]acetamide
CID 118957780
N-benzyl-2-[(4R)-4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl]-N-propan-2-ylacetamide
CID 2513176
N-benzyl-2-[(3S)-6-[bis(methylsulfonyl)amino]-2',5'-dioxospiro[1,2-dihydroindene-3,4'-imidazolidine]-1'-yl]-N-(1-cyclopropylethyl)acetamide
CID 145048809
1-[2-[benzyl(1-cyclopropylethyl)amino]-2-oxoethyl]-2,5-dioxospiro[imidazolidine-4,1'-indene]-4'-carboxamide
CID 122459891
N-[(1S)-1-cyclopropylethyl]-2-[(3S)-2',5'-dioxospiro[1,2-dihydroindene-3,4'-imidazolidine]-1'-yl]-N-[(4-fluorophenyl)methyl]acetamide
CID 118957462
N-benzyl-N-[(1S)-1-cyclopropylethyl]-2-[1,1,2',5'-tetraoxo-6-(1H-pyrazol-5-yl)spiro[2H-1-benzothiophene-3,4'-imidazolidine]-1'-yl]acetamide
CID 118957490
N-benzyl-N-[(1S)-1-cyclopropylethyl]-2-[6-(3-hydroxyprop-1-ynyl)-2',5'-dioxospiro[1,2-dihydroindene-3,4'-imidazolidine]-1'-yl]acetamide
CID 118958128
N-[(4-bromophenyl)methyl]-N-(1-cyclopropylethyl)-2-(2',5'-dioxospiro[1,2-dihydroindene-3,4'-imidazolidine]-1'-yl)acetamide
CID 118958027
N-benzyl-N-[(1S)-1-cyclopropylethyl]-2-[6-(3-hydroxy-3-methylbut-1-ynyl)-2',5'-dioxospiro[1,2-dihydroindene-3,4'-imidazolidine]-1'-yl]acetamide
CID 118957027
5-(2,5-dimethylfuran-3-yl)-3-[2-(3,4-dimethylphenyl)-2-oxoethyl]-5-methylimidazolidine-2,4-dione
CID 60620193

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-(1-cyclopropylethyl)-2-[4-(2,5-dimethylfuran-3-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide?
The IUPAC name of N-benzyl-N-(1-cyclopropylethyl)-2-[4-(2,5-dimethylfuran-3-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide (CID 60620285) is N-benzyl-N-(1-cyclopropylethyl)-2-[4-(2,5-dimethylfuran-3-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide.
What is the SMILES notation for N-benzyl-N-(1-cyclopropylethyl)-2-[4-(2,5-dimethylfuran-3-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide?
The canonical SMILES for N-benzyl-N-(1-cyclopropylethyl)-2-[4-(2,5-dimethylfuran-3-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide is Cc1cc(C2(C)NC(=O)N(CC(=O)N(Cc3ccccc3)C(C)C3CC3)C2=O)c(C)o1.
What is the InChIKey of N-benzyl-N-(1-cyclopropylethyl)-2-[4-(2,5-dimethylfuran-3-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide?
The InChIKey is CUFRJQFXSIWVLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29N3O4/c1-15-12-20(17(3)31-15)24(4)22(29)27(23(30)25-24)14-21(28)26(16(2)19-10-11-19)13-18-8-6-5-7-9-18/h5-9,12,16,19H,10-11,13-14H2,1-4H3,(H,25,30).
What are the key properties of N-benzyl-N-(1-cyclopropylethyl)-2-[4-(2,5-dimethylfuran-3-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide?
N-benzyl-N-(1-cyclopropylethyl)-2-[4-(2,5-dimethylfuran-3-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide has a molecular weight of 423.51 g/mol, XLogP of 3.49, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-(1-cyclopropylethyl)-2-[4-(2,5-dimethylfuran-3-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide is sourced from PubChem (CID 60620285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).