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

C20H29N3O3 — CID 42989141

IUPACN-(3-methylbutan-2-yl)-2-[4-(2-methylpropyl)-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide
SMILESCC(C)CC1(c2ccccc2)NC(=O)N(CC(=O)NC(C)C(C)C)C1=O
InChIInChI=1S/C20H29N3O3/c1-13(2)11-20(16-9-7-6-8-10-16)18(25)23(19(26)22-20)12-17(24)21-15(5)14(3)4/h6-10,13-15H,11-12H2,1-5H3,(H,21,24)(H,22,26)
InChIKeyUWMRDNMNOMBLDJ-UHFFFAOYSA-N
MW359.47 g/mol
LogP2.64
Rot. Bonds7

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

N-(3-methylbutan-2-yl)-2-[4-(2-methylpropyl)-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide (PubChem CID 42989141) has the molecular formula C20H29N3O3 and a molecular weight of 359.47 g/mol. Its IUPAC name is N-(3-methylbutan-2-yl)-2-[4-(2-methylpropyl)-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide.

Molecular Properties

Compound NameN-(3-methylbutan-2-yl)-2-[4-(2-methylpropyl)-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide
PubChem CID42989141
Molecular FormulaC20H29N3O3
Molecular Weight359.47 g/mol
Exact Mass359.22
IUPAC NameN-(3-methylbutan-2-yl)-2-[4-(2-methylpropyl)-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide
SMILESCC(C)CC1(c2ccccc2)NC(=O)N(CC(=O)NC(C)C(C)C)C1=O
InChIInChI=1S/C20H29N3O3/c1-13(2)11-20(16-9-7-6-8-10-16)18(25)23(19(26)22-20)12-17(24)21-15(5)14(3)4/h6-10,13-15H,11-12H2,1-5H3,(H,21,24)(H,22,26)
InChIKeyUWMRDNMNOMBLDJ-UHFFFAOYSA-N
XLogP2.64
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.47
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(5-methyl-1,2-oxazol-3-yl)-2-[(4S)-4-(2-methylpropyl)-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide
CID 40920192
2-[(4S)-4-butyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]-N-[(2R)-3-methylbutan-2-yl]acetamide
CID 7620481
2-[(4R)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-[(2R)-pentan-2-yl]acetamide
CID 8849641
2-[(4R)-2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl]-N-[(2R)-5-methylhexan-2-yl]acetamide
CID 8572588
2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-(3-methyl-1-phenylbutyl)acetamide
CID 43027676
2-[(4R)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-[(2R)-1-methoxypropan-2-yl]acetamide
CID 7179501
2-[(4S)-2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl]-N-[(1S)-3-methyl-1-phenylbutyl]acetamide
CID 8521761
N-benzhydryl-2-[(4S)-2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl]acetamide
CID 25340413
3-[(4-fluorophenyl)methyl]-5-(2-methylpropyl)-5-phenylimidazolidine-2,4-dione
CID 18165746
2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(6-methylheptan-2-yl)acetamide
CID 46606290
2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-[1-(2-methoxyphenyl)ethyl]acetamide
CID 24544890
N-[(2S)-3-methylbutan-2-yl]-2-[(4S)-4-methyl-2,5-dioxo-4-(4-propan-2-ylphenyl)imidazolidin-1-yl]acetamide
CID 7802579

Frequently Asked Questions

What is the IUPAC name of N-(3-methylbutan-2-yl)-2-[4-(2-methylpropyl)-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide?
The IUPAC name of N-(3-methylbutan-2-yl)-2-[4-(2-methylpropyl)-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide (CID 42989141) is N-(3-methylbutan-2-yl)-2-[4-(2-methylpropyl)-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide.
What is the SMILES notation for N-(3-methylbutan-2-yl)-2-[4-(2-methylpropyl)-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide?
The canonical SMILES for N-(3-methylbutan-2-yl)-2-[4-(2-methylpropyl)-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide is CC(C)CC1(c2ccccc2)NC(=O)N(CC(=O)NC(C)C(C)C)C1=O.
What is the InChIKey of N-(3-methylbutan-2-yl)-2-[4-(2-methylpropyl)-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide?
The InChIKey is UWMRDNMNOMBLDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29N3O3/c1-13(2)11-20(16-9-7-6-8-10-16)18(25)23(19(26)22-20)12-17(24)21-15(5)14(3)4/h6-10,13-15H,11-12H2,1-5H3,(H,21,24)(H,22,26).
What are the key properties of N-(3-methylbutan-2-yl)-2-[4-(2-methylpropyl)-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide?
N-(3-methylbutan-2-yl)-2-[4-(2-methylpropyl)-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide has a molecular weight of 359.47 g/mol, XLogP of 2.64, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylbutan-2-yl)-2-[4-(2-methylpropyl)-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide is sourced from PubChem (CID 42989141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).