2-(2,5-dioxo-3-phenylimidazolidin-1-yl)-N,N-bis(3-methylbutyl)acetamide

C21H31N3O3 — CID 55867688

IUPAC2-(2,5-dioxo-3-phenylimidazolidin-1-yl)-N,N-bis(3-methylbutyl)acetamide
SMILESCC(C)CCN(CCC(C)C)C(=O)CN1C(=O)CN(c2ccccc2)C1=O
InChIInChI=1S/C21H31N3O3/c1-16(2)10-12-22(13-11-17(3)4)19(25)14-24-20(26)15-23(21(24)27)18-8-6-5-7-9-18/h5-9,16-17H,10-15H2,1-4H3
InChIKeyFJLOUMSFZFNTGL-UHFFFAOYSA-N
MW373.50 g/mol
LogP3.38
Rot. Bonds9

About 2-(2,5-dioxo-3-phenylimidazolidin-1-yl)-N,N-bis(3-methylbutyl)acetamide

2-(2,5-dioxo-3-phenylimidazolidin-1-yl)-N,N-bis(3-methylbutyl)acetamide (PubChem CID 55867688) has the molecular formula C21H31N3O3 and a molecular weight of 373.50 g/mol. Its IUPAC name is 2-(2,5-dioxo-3-phenylimidazolidin-1-yl)-N,N-bis(3-methylbutyl)acetamide.

Molecular Properties

Compound Name2-(2,5-dioxo-3-phenylimidazolidin-1-yl)-N,N-bis(3-methylbutyl)acetamide
PubChem CID55867688
Molecular FormulaC21H31N3O3
Molecular Weight373.50 g/mol
Exact Mass373.24
IUPAC Name2-(2,5-dioxo-3-phenylimidazolidin-1-yl)-N,N-bis(3-methylbutyl)acetamide
SMILESCC(C)CCN(CCC(C)C)C(=O)CN1C(=O)CN(c2ccccc2)C1=O
InChIInChI=1S/C21H31N3O3/c1-16(2)10-12-22(13-11-17(3)4)19(25)14-24-20(26)15-23(21(24)27)18-8-6-5-7-9-18/h5-9,16-17H,10-15H2,1-4H3
InChIKeyFJLOUMSFZFNTGL-UHFFFAOYSA-N
XLogP3.38
TPSA60.93 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.50
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(2,5-dioxo-3-phenylimidazolidin-1-yl)-N-methyl-N-(1-phenylethyl)acetamide
CID 60519018
2-(2,5-dioxo-3-phenylimidazolidin-1-yl)-N-methyl-N-(4-methylcyclohexyl)acetamide
CID 60519085
3-[2-[2,5-dimethyl-1-(3-methylbutyl)pyrrol-3-yl]-2-oxoethyl]-1-phenylimidazolidine-2,4-dione
CID 60519577
2-(2,5-dioxo-3-phenylimidazolidin-1-yl)-N-ethyl-N-[(4-phenylmethoxyphenyl)methyl]acetamide
CID 56522106
2-(2,5-dioxo-3-phenylimidazolidin-1-yl)-N-ethyl-N-naphthalen-1-ylacetamide
CID 60519700
3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-1-phenylimidazolidine-2,4-dione
CID 60519605
2-(2,5-dioxo-3-phenylimidazolidin-1-yl)-N-[1-(4-ethylphenyl)ethyl]acetamide
CID 60519723
3-[2-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-2-oxoethyl]-1-phenylimidazolidine-2,4-dione
CID 60519177
N-(3-aminopropyl)-N-benzyl-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide
CID 120648461
3-[2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-2-oxoethyl]-1-phenylimidazolidine-2,4-dione
CID 136577810
1-phenyl-3-(2,2,2-trifluoroethyl)imidazolidine-2,4-dione
CID 113225089
3-[[2-(1,3-dioxoisoindol-2-yl)acetyl]-(2-methylpropyl)amino]propanoic acid
CID 119190371

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dioxo-3-phenylimidazolidin-1-yl)-N,N-bis(3-methylbutyl)acetamide?
The IUPAC name of 2-(2,5-dioxo-3-phenylimidazolidin-1-yl)-N,N-bis(3-methylbutyl)acetamide (CID 55867688) is 2-(2,5-dioxo-3-phenylimidazolidin-1-yl)-N,N-bis(3-methylbutyl)acetamide.
What is the SMILES notation for 2-(2,5-dioxo-3-phenylimidazolidin-1-yl)-N,N-bis(3-methylbutyl)acetamide?
The canonical SMILES for 2-(2,5-dioxo-3-phenylimidazolidin-1-yl)-N,N-bis(3-methylbutyl)acetamide is CC(C)CCN(CCC(C)C)C(=O)CN1C(=O)CN(c2ccccc2)C1=O.
What is the InChIKey of 2-(2,5-dioxo-3-phenylimidazolidin-1-yl)-N,N-bis(3-methylbutyl)acetamide?
The InChIKey is FJLOUMSFZFNTGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H31N3O3/c1-16(2)10-12-22(13-11-17(3)4)19(25)14-24-20(26)15-23(21(24)27)18-8-6-5-7-9-18/h5-9,16-17H,10-15H2,1-4H3.
What are the key properties of 2-(2,5-dioxo-3-phenylimidazolidin-1-yl)-N,N-bis(3-methylbutyl)acetamide?
2-(2,5-dioxo-3-phenylimidazolidin-1-yl)-N,N-bis(3-methylbutyl)acetamide has a molecular weight of 373.50 g/mol, XLogP of 3.38, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dioxo-3-phenylimidazolidin-1-yl)-N,N-bis(3-methylbutyl)acetamide is sourced from PubChem (CID 55867688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).