3-(1-aminopropan-2-yl)-5-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazolidine-2,4-dione

C17H23N3O2 — CID 82148372

IUPAC3-(1-aminopropan-2-yl)-5-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazolidine-2,4-dione
SMILESCC(CN)N1C(=O)NC(C)(c2ccc3c(c2)CCCC3)C1=O
InChIInChI=1S/C17H23N3O2/c1-11(10-18)20-15(21)17(2,19-16(20)22)14-8-7-12-5-3-4-6-13(12)9-14/h7-9,11H,3-6,10,18H2,1-2H3,(H,19,22)
InChIKeyFMBYZEFSFYMKEM-UHFFFAOYSA-N
MW301.39 g/mol
LogP1.68
Rot. Bonds3

About 3-(1-aminopropan-2-yl)-5-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazolidine-2,4-dione

3-(1-aminopropan-2-yl)-5-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazolidine-2,4-dione (PubChem CID 82148372) has the molecular formula C17H23N3O2 and a molecular weight of 301.39 g/mol. Its IUPAC name is 3-(1-aminopropan-2-yl)-5-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name3-(1-aminopropan-2-yl)-5-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazolidine-2,4-dione
PubChem CID82148372
Molecular FormulaC17H23N3O2
Molecular Weight301.39 g/mol
Exact Mass301.18
IUPAC Name3-(1-aminopropan-2-yl)-5-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazolidine-2,4-dione
SMILESCC(CN)N1C(=O)NC(C)(c2ccc3c(c2)CCCC3)C1=O
InChIInChI=1S/C17H23N3O2/c1-11(10-18)20-15(21)17(2,19-16(20)22)14-8-7-12-5-3-4-6-13(12)9-14/h7-9,11H,3-6,10,18H2,1-2H3,(H,19,22)
InChIKeyFMBYZEFSFYMKEM-UHFFFAOYSA-N
XLogP1.68
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 51.68
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-(1-aminopropan-2-yl)-5-methyl-5-naphthalen-2-ylimidazolidine-2,4-dione
CID 82148377
(2S)-N-cyclohexyl-2-[(4S)-4-(2,3-dihydro-1H-inden-5-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]propanamide
CID 9449775
3-(1-aminopropan-2-yl)-5-(furan-2-yl)-5-methylimidazolidine-2,4-dione
CID 82148391
(5S)-5-(2,3-dihydro-1H-inden-5-yl)-5-methyl-3-[(4-methylsulfanylphenyl)methyl]imidazolidine-2,4-dione
CID 7988392
(5S)-5-(2,3-dihydro-1H-inden-5-yl)-5-methyl-3-(2-oxo-2-pyrrolidin-1-ylethyl)imidazolidine-2,4-dione
CID 8011147
N-[[(4S)-4-(2,3-dihydro-1H-inden-5-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]methyl]-N-methylmethanesulfonamide
CID 97248650
4-[[4-(2,3-dihydro-1H-inden-5-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]methyl]-N,N-dimethylbenzamide
CID 78764207
7-(1-aminopropan-2-yl)-2-oxa-5,7-diazaspiro[3.4]octane-6,8-dione
CID 82397919
5-(2,3-dihydro-1H-inden-5-yl)-5-methyl-3-(3-phenoxypropyl)imidazolidine-2,4-dione
CID 60602072
N-[4-[2-[4-(2,3-dihydro-1H-inden-5-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetyl]phenyl]-2-methylpropanamide
CID 42918429
(5R)-5-(2,3-dihydro-1H-inden-5-yl)-3-[2-(2,5-dimethyl-1-propan-2-ylpyrrol-3-yl)-2-oxoethyl]-5-methylimidazolidine-2,4-dione
CID 7883938
5-(2,3-dihydro-1H-inden-5-yl)-3-(2-hydroxy-3-phenoxypropyl)-5-methylimidazolidine-2,4-dione
CID 46613397

Frequently Asked Questions

What is the IUPAC name of 3-(1-aminopropan-2-yl)-5-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazolidine-2,4-dione?
The IUPAC name of 3-(1-aminopropan-2-yl)-5-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazolidine-2,4-dione (CID 82148372) is 3-(1-aminopropan-2-yl)-5-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazolidine-2,4-dione.
What is the SMILES notation for 3-(1-aminopropan-2-yl)-5-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazolidine-2,4-dione?
The canonical SMILES for 3-(1-aminopropan-2-yl)-5-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazolidine-2,4-dione is CC(CN)N1C(=O)NC(C)(c2ccc3c(c2)CCCC3)C1=O.
What is the InChIKey of 3-(1-aminopropan-2-yl)-5-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazolidine-2,4-dione?
The InChIKey is FMBYZEFSFYMKEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O2/c1-11(10-18)20-15(21)17(2,19-16(20)22)14-8-7-12-5-3-4-6-13(12)9-14/h7-9,11H,3-6,10,18H2,1-2H3,(H,19,22).
What are the key properties of 3-(1-aminopropan-2-yl)-5-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazolidine-2,4-dione?
3-(1-aminopropan-2-yl)-5-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazolidine-2,4-dione has a molecular weight of 301.39 g/mol, XLogP of 1.68, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-aminopropan-2-yl)-5-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazolidine-2,4-dione is sourced from PubChem (CID 82148372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).