2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(1-methyl-2,3-dihydroindol-6-yl)acetamide

C16H20N4O3 — CID 154751837

IUPAC2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(1-methyl-2,3-dihydroindol-6-yl)acetamide
SMILESCN1CCc2ccc(NC(=O)CN3C(=O)NC(C)(C)C3=O)cc21
InChIInChI=1S/C16H20N4O3/c1-16(2)14(22)20(15(23)18-16)9-13(21)17-11-5-4-10-6-7-19(3)12(10)8-11/h4-5,8H,6-7,9H2,1-3H3,(H,17,21)(H,18,23)
InChIKeyAVAJDQZCIUQELN-UHFFFAOYSA-N
MW316.36 g/mol
LogP0.95
Rot. Bonds3

About 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(1-methyl-2,3-dihydroindol-6-yl)acetamide

2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(1-methyl-2,3-dihydroindol-6-yl)acetamide (PubChem CID 154751837) has the molecular formula C16H20N4O3 and a molecular weight of 316.36 g/mol. Its IUPAC name is 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(1-methyl-2,3-dihydroindol-6-yl)acetamide.

Molecular Properties

Compound Name2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(1-methyl-2,3-dihydroindol-6-yl)acetamide
PubChem CID154751837
Molecular FormulaC16H20N4O3
Molecular Weight316.36 g/mol
Exact Mass316.15
IUPAC Name2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(1-methyl-2,3-dihydroindol-6-yl)acetamide
SMILESCN1CCc2ccc(NC(=O)CN3C(=O)NC(C)(C)C3=O)cc21
InChIInChI=1S/C16H20N4O3/c1-16(2)14(22)20(15(23)18-16)9-13(21)17-11-5-4-10-6-7-19(3)12(10)8-11/h4-5,8H,6-7,9H2,1-3H3,(H,17,21)(H,18,23)
InChIKeyAVAJDQZCIUQELN-UHFFFAOYSA-N
XLogP0.95
TPSA81.75 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.36
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3,3-dimethyl-N-(1-methyl-2,3-dihydroindol-6-yl)butanamide
CID 110729245
N-(3-acetylphenyl)-2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)acetamide
CID 2547789
N-(2,3-dihydro-1H-inden-5-yl)-2-(2,4-dioxo-1,3-diazaspiro[4.7]dodecan-3-yl)acetamide
CID 2667756
N-(3-chloro-4-cyanophenyl)-2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)acetamide
CID 7181965
N-(2,3-dihydro-1H-inden-5-yl)-2-[4-(furan-2-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 17394782
N-(3,4-dimethylphenyl)-2-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide
CID 2622570
2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(4-phenoxyphenyl)acetamide
CID 7269459
N-[4-(cyanomethyl)phenyl]-2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)acetamide
CID 7995035
4-[[2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)acetyl]amino]-N-(4-methoxyphenyl)benzamide
CID 7182046
[2-(3,4-dimethylanilino)-2-oxoethyl] 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)acetate
CID 7209846
2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(2,4-dimethylphenyl)acetamide
CID 7182030
N-(2,4-dibromophenyl)-2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)acetamide
CID 2558770

Frequently Asked Questions

What is the IUPAC name of 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(1-methyl-2,3-dihydroindol-6-yl)acetamide?
The IUPAC name of 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(1-methyl-2,3-dihydroindol-6-yl)acetamide (CID 154751837) is 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(1-methyl-2,3-dihydroindol-6-yl)acetamide.
What is the SMILES notation for 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(1-methyl-2,3-dihydroindol-6-yl)acetamide?
The canonical SMILES for 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(1-methyl-2,3-dihydroindol-6-yl)acetamide is CN1CCc2ccc(NC(=O)CN3C(=O)NC(C)(C)C3=O)cc21.
What is the InChIKey of 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(1-methyl-2,3-dihydroindol-6-yl)acetamide?
The InChIKey is AVAJDQZCIUQELN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O3/c1-16(2)14(22)20(15(23)18-16)9-13(21)17-11-5-4-10-6-7-19(3)12(10)8-11/h4-5,8H,6-7,9H2,1-3H3,(H,17,21)(H,18,23).
What are the key properties of 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(1-methyl-2,3-dihydroindol-6-yl)acetamide?
2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(1-methyl-2,3-dihydroindol-6-yl)acetamide has a molecular weight of 316.36 g/mol, XLogP of 0.95, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(1-methyl-2,3-dihydroindol-6-yl)acetamide is sourced from PubChem (CID 154751837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).