N-cyclopropyl-2-[methyl-[[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]methyl]amino]acetamide

C17H22N4O3 — CID 9286078

IUPACN-cyclopropyl-2-[methyl-[[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]methyl]amino]acetamide
SMILESCN(CC(=O)NC1CC1)CN1C(=O)N[C@](C)(c2ccccc2)C1=O
InChIInChI=1S/C17H22N4O3/c1-17(12-6-4-3-5-7-12)15(23)21(16(24)19-17)11-20(2)10-14(22)18-13-8-9-13/h3-7,13H,8-11H2,1-2H3,(H,18,22)(H,19,24)/t17-/m1/s1
InChIKeyMGAWHODDVJURAA-QGZVFWFLSA-N
MW330.39 g/mol
LogP0.62
Rot. Bonds6

About N-cyclopropyl-2-[methyl-[[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]methyl]amino]acetamide

N-cyclopropyl-2-[methyl-[[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]methyl]amino]acetamide (PubChem CID 9286078) has the molecular formula C17H22N4O3 and a molecular weight of 330.39 g/mol. Its IUPAC name is N-cyclopropyl-2-[methyl-[[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]methyl]amino]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[methyl-[[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]methyl]amino]acetamide
PubChem CID9286078
Molecular FormulaC17H22N4O3
Molecular Weight330.39 g/mol
Exact Mass330.17
IUPAC NameN-cyclopropyl-2-[methyl-[[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]methyl]amino]acetamide
SMILESCN(CC(=O)NC1CC1)CN1C(=O)N[C@](C)(c2ccccc2)C1=O
InChIInChI=1S/C17H22N4O3/c1-17(12-6-4-3-5-7-12)15(23)21(16(24)19-17)11-20(2)10-14(22)18-13-8-9-13/h3-7,13H,8-11H2,1-2H3,(H,18,22)(H,19,24)/t17-/m1/s1
InChIKeyMGAWHODDVJURAA-QGZVFWFLSA-N
XLogP0.62
TPSA81.75 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.39
LogP ≤ 50.62
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

N-cyclopropyl-2-[[(4R)-4-(3-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]methyl-methylamino]acetamide
CID 9286027
N-(4-methylcyclohexyl)-2-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide
CID 7043085
N-cyclopentyl-2-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide
CID 2580741
N-cyclohexyl-2-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide
CID 2580985
3-[[benzyl(methyl)amino]methyl]-5-methyl-5-phenylimidazolidine-2,4-dione
CID 4215276
N-[(3R)-1,1-dioxothiolan-3-yl]-2-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide
CID 2646971
N-[2-(cyclopropylamino)-2-oxoethyl]-2-[(4R)-4-(2,3-dihydro-1H-inden-5-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-methylacetamide
CID 8602029
N-tert-butyl-2-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methyl-methylamino]acetamide
CID 9280956
N-[(1S)-1-cyclopropylethyl]-2-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide
CID 40748494
N-methyl-4-[[methyl-[[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]methyl]amino]methyl]benzamide
CID 9323282
N-[(1S,2S,3R)-2,3-dimethylcyclohexyl]-2-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide
CID 124719135
N-cyclopentyl-2-[(4S)-4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide
CID 2582043

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[methyl-[[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]methyl]amino]acetamide?
The IUPAC name of N-cyclopropyl-2-[methyl-[[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]methyl]amino]acetamide (CID 9286078) is N-cyclopropyl-2-[methyl-[[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]methyl]amino]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[methyl-[[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]methyl]amino]acetamide?
The canonical SMILES for N-cyclopropyl-2-[methyl-[[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]methyl]amino]acetamide is CN(CC(=O)NC1CC1)CN1C(=O)N[C@](C)(c2ccccc2)C1=O.
What is the InChIKey of N-cyclopropyl-2-[methyl-[[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]methyl]amino]acetamide?
The InChIKey is MGAWHODDVJURAA-QGZVFWFLSA-N. The full InChI is InChI=1S/C17H22N4O3/c1-17(12-6-4-3-5-7-12)15(23)21(16(24)19-17)11-20(2)10-14(22)18-13-8-9-13/h3-7,13H,8-11H2,1-2H3,(H,18,22)(H,19,24)/t17-/m1/s1.
What are the key properties of N-cyclopropyl-2-[methyl-[[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]methyl]amino]acetamide?
N-cyclopropyl-2-[methyl-[[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]methyl]amino]acetamide has a molecular weight of 330.39 g/mol, XLogP of 0.62, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[methyl-[[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]methyl]amino]acetamide is sourced from PubChem (CID 9286078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).