2-[benzyl(cyclopropyl)amino]-N-[(4S)-4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide

C18H24N4O3 — CID 34205258

IUPAC2-[benzyl(cyclopropyl)amino]-N-[(4S)-4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
SMILESCC[C@]1(C)NC(=O)N(NC(=O)CN(Cc2ccccc2)C2CC2)C1=O
InChIInChI=1S/C18H24N4O3/c1-3-18(2)16(24)22(17(25)19-18)20-15(23)12-21(14-9-10-14)11-13-7-5-4-6-8-13/h4-8,14H,3,9-12H2,1-2H3,(H,19,25)(H,20,23)/t18-/m0/s1
InChIKeyLNMLJYIQVNHGOY-SFHVURJKSA-N
MW344.41 g/mol
LogP1.40
Rot. Bonds7

About 2-[benzyl(cyclopropyl)amino]-N-[(4S)-4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide

2-[benzyl(cyclopropyl)amino]-N-[(4S)-4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide (PubChem CID 34205258) has the molecular formula C18H24N4O3 and a molecular weight of 344.41 g/mol. Its IUPAC name is 2-[benzyl(cyclopropyl)amino]-N-[(4S)-4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide.

Molecular Properties

Compound Name2-[benzyl(cyclopropyl)amino]-N-[(4S)-4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
PubChem CID34205258
Molecular FormulaC18H24N4O3
Molecular Weight344.41 g/mol
Exact Mass344.18
IUPAC Name2-[benzyl(cyclopropyl)amino]-N-[(4S)-4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
SMILESCC[C@]1(C)NC(=O)N(NC(=O)CN(Cc2ccccc2)C2CC2)C1=O
InChIInChI=1S/C18H24N4O3/c1-3-18(2)16(24)22(17(25)19-18)20-15(23)12-21(14-9-10-14)11-13-7-5-4-6-8-13/h4-8,14H,3,9-12H2,1-2H3,(H,19,25)(H,20,23)/t18-/m0/s1
InChIKeyLNMLJYIQVNHGOY-SFHVURJKSA-N
XLogP1.40
TPSA81.75 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.41
LogP ≤ 51.40
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-4-[[cyclopropyl-[2-[(4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl)amino]-2-oxoethyl]amino]methyl]benzamide
CID 46594516
2-[benzyl(cyclopropyl)amino]-N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide
CID 32512117
2-[cyclopropyl-[(4-fluorophenyl)methyl]amino]-N-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide
CID 8905929
2-[[(1S)-2,3-dihydro-1H-inden-1-yl]-methylamino]-N-[(4R)-4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 124838905
N-(4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-2-[methyl-[[2-(trifluoromethyl)phenyl]methyl]amino]acetamide
CID 42944314
2-[bis(furan-2-ylmethyl)amino]-N-[(4R)-4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 40880178
2-[(4-ethylphenyl)methyl-methylamino]-N-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide
CID 8794419
N-[4-methyl-2,5-dioxo-4-(2-phenylethyl)imidazolidin-1-yl]butanamide
CID 136513403
2-[[(1R)-2,3-dihydro-1H-inden-1-yl]-methylamino]-N-[(4R)-4-methyl-2,5-dioxo-4-(2-phenylethyl)imidazolidin-1-yl]acetamide
CID 34201331
N-(4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-2-[2-(2-methylphenyl)pyrrolidin-1-yl]acetamide
CID 55828676
2-[(3-fluorophenyl)methyl-methylamino]-N-[4-methyl-2,5-dioxo-4-(2-phenylethyl)imidazolidin-1-yl]acetamide
CID 18088033
2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-[(4R)-4-methyl-2,5-dioxo-4-(2-phenylethyl)imidazolidin-1-yl]acetamide
CID 8695250

Frequently Asked Questions

What is the IUPAC name of 2-[benzyl(cyclopropyl)amino]-N-[(4S)-4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide?
The IUPAC name of 2-[benzyl(cyclopropyl)amino]-N-[(4S)-4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide (CID 34205258) is 2-[benzyl(cyclopropyl)amino]-N-[(4S)-4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide.
What is the SMILES notation for 2-[benzyl(cyclopropyl)amino]-N-[(4S)-4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide?
The canonical SMILES for 2-[benzyl(cyclopropyl)amino]-N-[(4S)-4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide is CC[C@]1(C)NC(=O)N(NC(=O)CN(Cc2ccccc2)C2CC2)C1=O.
What is the InChIKey of 2-[benzyl(cyclopropyl)amino]-N-[(4S)-4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide?
The InChIKey is LNMLJYIQVNHGOY-SFHVURJKSA-N. The full InChI is InChI=1S/C18H24N4O3/c1-3-18(2)16(24)22(17(25)19-18)20-15(23)12-21(14-9-10-14)11-13-7-5-4-6-8-13/h4-8,14H,3,9-12H2,1-2H3,(H,19,25)(H,20,23)/t18-/m0/s1.
What are the key properties of 2-[benzyl(cyclopropyl)amino]-N-[(4S)-4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide?
2-[benzyl(cyclopropyl)amino]-N-[(4S)-4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide has a molecular weight of 344.41 g/mol, XLogP of 1.40, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[benzyl(cyclopropyl)amino]-N-[(4S)-4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide is sourced from PubChem (CID 34205258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).