N-ethyl-2-[3-(3-methylbutyl)-2,5-dioxo-1-phenylimidazolidin-4-yl]acetamide

C18H25N3O3 — CID 2983576

IUPACN-ethyl-2-[3-(3-methylbutyl)-2,5-dioxo-1-phenylimidazolidin-4-yl]acetamide
SMILESCCNC(=O)CC1C(=O)N(c2ccccc2)C(=O)N1CCC(C)C
InChIInChI=1S/C18H25N3O3/c1-4-19-16(22)12-15-17(23)21(14-8-6-5-7-9-14)18(24)20(15)11-10-13(2)3/h5-9,13,15H,4,10-12H2,1-3H3,(H,19,22)
InChIKeyQNUJRAYZFDWHEF-UHFFFAOYSA-N
MW331.42 g/mol
LogP2.40
Rot. Bonds7

About N-ethyl-2-[3-(3-methylbutyl)-2,5-dioxo-1-phenylimidazolidin-4-yl]acetamide

N-ethyl-2-[3-(3-methylbutyl)-2,5-dioxo-1-phenylimidazolidin-4-yl]acetamide (PubChem CID 2983576) has the molecular formula C18H25N3O3 and a molecular weight of 331.42 g/mol. Its IUPAC name is N-ethyl-2-[3-(3-methylbutyl)-2,5-dioxo-1-phenylimidazolidin-4-yl]acetamide.

Molecular Properties

Compound NameN-ethyl-2-[3-(3-methylbutyl)-2,5-dioxo-1-phenylimidazolidin-4-yl]acetamide
PubChem CID2983576
Molecular FormulaC18H25N3O3
Molecular Weight331.42 g/mol
Exact Mass331.19
IUPAC NameN-ethyl-2-[3-(3-methylbutyl)-2,5-dioxo-1-phenylimidazolidin-4-yl]acetamide
SMILESCCNC(=O)CC1C(=O)N(c2ccccc2)C(=O)N1CCC(C)C
InChIInChI=1S/C18H25N3O3/c1-4-19-16(22)12-15-17(23)21(14-8-6-5-7-9-14)18(24)20(15)11-10-13(2)3/h5-9,13,15H,4,10-12H2,1-3H3,(H,19,22)
InChIKeyQNUJRAYZFDWHEF-UHFFFAOYSA-N
XLogP2.40
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.42
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-Phenyl-1,3,8-triazaspiro(4.5)decan-4-one
CID 70556
4-Imidazolidineacetic acid, 2,5-dioxo-1-phenyl-
CID 2913270
1-Phenylimidazolidine-2,4-dione
CID 570576
3-Phenylimidazolidine-2,4-dione
CID 227930
1-cyclohexyl-5-oxo-N-phenylpyrrolidine-3-carboxamide
CID 2883505
8-Cyclodecyl-1-phenyl-1,3,8-triaza-spiro[4.5]decan-4-one
CID 9842289
8-Cyclononyl-1-phenyl-1,3,8-triaza-spiro[4.5]decan-4-one
CID 9885004
8-Cyclododecyl-1-phenyl-1,3,8-triaza-spiro[4.5]decan-4-one
CID 10000890
8-Cycloundecyl-1-phenyl-1,3,8-triaza-spiro[4.5]decan-4-one
CID 19347356
(S)-N-(1-amino-3,3-dimethyl-1-oxobutan-2-yl)-3-isopentyl-2-oxo-2,3-dihydrobenzo[d]imidazole-1-carboxamide
CID 44576654
N-(4-acetamidophenyl)-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide
CID 3156931
2-(2,5-dioxoimidazolidin-1-yl)-N-(p-tolyl)acetamide
CID 2162395

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[3-(3-methylbutyl)-2,5-dioxo-1-phenylimidazolidin-4-yl]acetamide?
The IUPAC name of N-ethyl-2-[3-(3-methylbutyl)-2,5-dioxo-1-phenylimidazolidin-4-yl]acetamide (CID 2983576) is N-ethyl-2-[3-(3-methylbutyl)-2,5-dioxo-1-phenylimidazolidin-4-yl]acetamide.
What is the SMILES notation for N-ethyl-2-[3-(3-methylbutyl)-2,5-dioxo-1-phenylimidazolidin-4-yl]acetamide?
The canonical SMILES for N-ethyl-2-[3-(3-methylbutyl)-2,5-dioxo-1-phenylimidazolidin-4-yl]acetamide is CCNC(=O)CC1C(=O)N(c2ccccc2)C(=O)N1CCC(C)C.
What is the InChIKey of N-ethyl-2-[3-(3-methylbutyl)-2,5-dioxo-1-phenylimidazolidin-4-yl]acetamide?
The InChIKey is QNUJRAYZFDWHEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O3/c1-4-19-16(22)12-15-17(23)21(14-8-6-5-7-9-14)18(24)20(15)11-10-13(2)3/h5-9,13,15H,4,10-12H2,1-3H3,(H,19,22).
What are the key properties of N-ethyl-2-[3-(3-methylbutyl)-2,5-dioxo-1-phenylimidazolidin-4-yl]acetamide?
N-ethyl-2-[3-(3-methylbutyl)-2,5-dioxo-1-phenylimidazolidin-4-yl]acetamide has a molecular weight of 331.42 g/mol, XLogP of 2.40, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[3-(3-methylbutyl)-2,5-dioxo-1-phenylimidazolidin-4-yl]acetamide is sourced from PubChem (CID 2983576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).