3-[(4R)-2,5-dioxo-1-[(1R)-1-phenylethyl]imidazolidin-4-yl]-N-naphthalen-1-ylpropanamide

C24H23N3O3 — CID 51833335

IUPAC3-[(4R)-2,5-dioxo-1-[(1R)-1-phenylethyl]imidazolidin-4-yl]-N-naphthalen-1-ylpropanamide
SMILESC[C@H](c1ccccc1)N1C(=O)N[C@H](CCC(=O)Nc2cccc3ccccc23)C1=O
InChIInChI=1S/C24H23N3O3/c1-16(17-8-3-2-4-9-17)27-23(29)21(26-24(27)30)14-15-22(28)25-20-13-7-11-18-10-5-6-12-19(18)20/h2-13,16,21H,14-15H2,1H3,(H,25,28)(H,26,30)/t16-,21-/m1/s1
InChIKeyVRTQOIQRWLIOKJ-IIBYNOLFSA-N
MW401.47 g/mol
LogP4.24
Rot. Bonds6

About 3-[(4R)-2,5-dioxo-1-[(1R)-1-phenylethyl]imidazolidin-4-yl]-N-naphthalen-1-ylpropanamide

3-[(4R)-2,5-dioxo-1-[(1R)-1-phenylethyl]imidazolidin-4-yl]-N-naphthalen-1-ylpropanamide (PubChem CID 51833335) has the molecular formula C24H23N3O3 and a molecular weight of 401.47 g/mol. Its IUPAC name is 3-[(4R)-2,5-dioxo-1-[(1R)-1-phenylethyl]imidazolidin-4-yl]-N-naphthalen-1-ylpropanamide.

Molecular Properties

Compound Name3-[(4R)-2,5-dioxo-1-[(1R)-1-phenylethyl]imidazolidin-4-yl]-N-naphthalen-1-ylpropanamide
PubChem CID51833335
Molecular FormulaC24H23N3O3
Molecular Weight401.47 g/mol
Exact Mass401.17
IUPAC Name3-[(4R)-2,5-dioxo-1-[(1R)-1-phenylethyl]imidazolidin-4-yl]-N-naphthalen-1-ylpropanamide
SMILESC[C@H](c1ccccc1)N1C(=O)N[C@H](CCC(=O)Nc2cccc3ccccc23)C1=O
InChIInChI=1S/C24H23N3O3/c1-16(17-8-3-2-4-9-17)27-23(29)21(26-24(27)30)14-15-22(28)25-20-13-7-11-18-10-5-6-12-19(18)20/h2-13,16,21H,14-15H2,1H3,(H,25,28)(H,26,30)/t16-,21-/m1/s1
InChIKeyVRTQOIQRWLIOKJ-IIBYNOLFSA-N
XLogP4.24
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.47
LogP ≤ 54.24
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

3-[(4R)-2,5-dioxo-1-[(1S)-1-phenylethyl]imidazolidin-4-yl]-N-propylpropanamide
CID 51834190
3-[(4R)-2,5-dioxo-1-[(1R)-1-phenylethyl]imidazolidin-4-yl]-N-(4-phenoxyphenyl)propanamide
CID 51836598
3-[(4R)-2,5-dioxo-1-[(1S)-1-phenylethyl]imidazolidin-4-yl]-N-(9-ethylcarbazol-3-yl)propanamide
CID 51815621
N-cyclooctyl-3-[(4S)-2,5-dioxo-1-[(1R)-1-phenylethyl]imidazolidin-4-yl]propanamide
CID 18398126
3-[(4S)-2,5-dioxo-1-[(1R)-1-phenylethyl]imidazolidin-4-yl]-N-(furan-2-ylmethyl)propanamide
CID 51829656
N,N'-dinaphthalen-1-ylbutanediamide
CID 1346643
2-[[(1S)-2-methyl-1-phenylpropyl]amino]-N-naphthalen-1-ylacetamide
CID 9131594
(2R)-4-(naphthalen-1-ylamino)-4-oxo-2-phenylbutanoic acid
CID 851942
(2S)-2-(1,3-dioxoisoindol-2-yl)-N-naphthalen-1-ylpropanamide
CID 738623
3-[(4R)-1-[(4-methoxyphenyl)methyl]-2,5-dioxoimidazolidin-4-yl]-N-quinolin-5-ylpropanamide
CID 99870849
3-[1-[(4-methoxyphenyl)methyl]-2,5-dioxoimidazolidin-4-yl]-N-quinolin-5-ylpropanamide
CID 75531778
3-fluoro-N-naphthalen-1-ylpropanamide
CID 67224476

Frequently Asked Questions

What is the IUPAC name of 3-[(4R)-2,5-dioxo-1-[(1R)-1-phenylethyl]imidazolidin-4-yl]-N-naphthalen-1-ylpropanamide?
The IUPAC name of 3-[(4R)-2,5-dioxo-1-[(1R)-1-phenylethyl]imidazolidin-4-yl]-N-naphthalen-1-ylpropanamide (CID 51833335) is 3-[(4R)-2,5-dioxo-1-[(1R)-1-phenylethyl]imidazolidin-4-yl]-N-naphthalen-1-ylpropanamide.
What is the SMILES notation for 3-[(4R)-2,5-dioxo-1-[(1R)-1-phenylethyl]imidazolidin-4-yl]-N-naphthalen-1-ylpropanamide?
The canonical SMILES for 3-[(4R)-2,5-dioxo-1-[(1R)-1-phenylethyl]imidazolidin-4-yl]-N-naphthalen-1-ylpropanamide is C[C@H](c1ccccc1)N1C(=O)N[C@H](CCC(=O)Nc2cccc3ccccc23)C1=O.
What is the InChIKey of 3-[(4R)-2,5-dioxo-1-[(1R)-1-phenylethyl]imidazolidin-4-yl]-N-naphthalen-1-ylpropanamide?
The InChIKey is VRTQOIQRWLIOKJ-IIBYNOLFSA-N. The full InChI is InChI=1S/C24H23N3O3/c1-16(17-8-3-2-4-9-17)27-23(29)21(26-24(27)30)14-15-22(28)25-20-13-7-11-18-10-5-6-12-19(18)20/h2-13,16,21H,14-15H2,1H3,(H,25,28)(H,26,30)/t16-,21-/m1/s1.
What are the key properties of 3-[(4R)-2,5-dioxo-1-[(1R)-1-phenylethyl]imidazolidin-4-yl]-N-naphthalen-1-ylpropanamide?
3-[(4R)-2,5-dioxo-1-[(1R)-1-phenylethyl]imidazolidin-4-yl]-N-naphthalen-1-ylpropanamide has a molecular weight of 401.47 g/mol, XLogP of 4.24, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4R)-2,5-dioxo-1-[(1R)-1-phenylethyl]imidazolidin-4-yl]-N-naphthalen-1-ylpropanamide is sourced from PubChem (CID 51833335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).