(5S)-3-[[cyclohexyl(methyl)amino]methyl]-5-(2-methylpropyl)imidazolidine-2,4-dione

C15H27N3O2 — CID 41411898

IUPAC(5S)-3-[[cyclohexyl(methyl)amino]methyl]-5-(2-methylpropyl)imidazolidine-2,4-dione
SMILESCC(C)C[C@@H]1NC(=O)N(CN(C)C2CCCCC2)C1=O
InChIInChI=1S/C15H27N3O2/c1-11(2)9-13-14(19)18(15(20)16-13)10-17(3)12-7-5-4-6-8-12/h11-13H,4-10H2,1-3H3,(H,16,20)/t13-/m0/s1
InChIKeyJXTLHAUSYGRTSX-ZDUSSCGKSA-N
MW281.40 g/mol
LogP2.17
Rot. Bonds5

About (5S)-3-[[cyclohexyl(methyl)amino]methyl]-5-(2-methylpropyl)imidazolidine-2,4-dione

(5S)-3-[[cyclohexyl(methyl)amino]methyl]-5-(2-methylpropyl)imidazolidine-2,4-dione (PubChem CID 41411898) has the molecular formula C15H27N3O2 and a molecular weight of 281.40 g/mol. Its IUPAC name is (5S)-3-[[cyclohexyl(methyl)amino]methyl]-5-(2-methylpropyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name(5S)-3-[[cyclohexyl(methyl)amino]methyl]-5-(2-methylpropyl)imidazolidine-2,4-dione
PubChem CID41411898
Molecular FormulaC15H27N3O2
Molecular Weight281.40 g/mol
Exact Mass281.21
IUPAC Name(5S)-3-[[cyclohexyl(methyl)amino]methyl]-5-(2-methylpropyl)imidazolidine-2,4-dione
SMILESCC(C)C[C@@H]1NC(=O)N(CN(C)C2CCCCC2)C1=O
InChIInChI=1S/C15H27N3O2/c1-11(2)9-13-14(19)18(15(20)16-13)10-17(3)12-7-5-4-6-8-12/h11-13H,4-10H2,1-3H3,(H,16,20)/t13-/m0/s1
InChIKeyJXTLHAUSYGRTSX-ZDUSSCGKSA-N
XLogP2.17
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (5S)-3-[[cyclohexyl(methyl)amino]methyl]-5-(2-methylpropyl)imidazolidine-2,4-dione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-cyclohexyl-N-methyl-2-[4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide
CID 4520677
3-[[methyl-[(2-piperidin-1-ylphenyl)methyl]amino]methyl]-5-(2-methylpropyl)imidazolidine-2,4-dione
CID 17409217
(5R)-5-(2-methylpropyl)-3-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]imidazolidine-2,4-dione
CID 25439287
3-[[(4-tert-butylphenyl)methyl-methylamino]methyl]-5-(2-methylpropyl)imidazolidine-2,4-dione
CID 24505295
3-cyclobutyl-5-(2-methylpropyl)imidazolidine-2,4-dione
CID 115927918
(5R)-3-[[(2S)-2-ethylpiperidin-1-yl]methyl]-5-(2-methylpropyl)imidazolidine-2,4-dione
CID 98433677
2-[methyl-[[4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]methyl]amino]-N-propylacetamide
CID 24505268
(5S)-3-[(4-chlorophenyl)methyl]-5-(2-methylpropyl)imidazolidine-2,4-dione
CID 2604902
3-[[1-(1,3-benzothiazol-2-yl)ethyl-methylamino]methyl]-5-(2-methylpropyl)imidazolidine-2,4-dione
CID 24505334
N-benzyl-N-methyl-2-[(4S)-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide
CID 2704236
(5S)-3-[(2-fluorophenyl)methyl]-5-(2-methylpropyl)imidazolidine-2,4-dione
CID 2604891
1-cyclohexyl-3-(2-methylpropyl)-1,4-diazepane-2,5-dione
CID 64958879

Frequently Asked Questions

What is the IUPAC name of (5S)-3-[[cyclohexyl(methyl)amino]methyl]-5-(2-methylpropyl)imidazolidine-2,4-dione?
The IUPAC name of (5S)-3-[[cyclohexyl(methyl)amino]methyl]-5-(2-methylpropyl)imidazolidine-2,4-dione (CID 41411898) is (5S)-3-[[cyclohexyl(methyl)amino]methyl]-5-(2-methylpropyl)imidazolidine-2,4-dione.
What is the SMILES notation for (5S)-3-[[cyclohexyl(methyl)amino]methyl]-5-(2-methylpropyl)imidazolidine-2,4-dione?
The canonical SMILES for (5S)-3-[[cyclohexyl(methyl)amino]methyl]-5-(2-methylpropyl)imidazolidine-2,4-dione is CC(C)C[C@@H]1NC(=O)N(CN(C)C2CCCCC2)C1=O.
What is the InChIKey of (5S)-3-[[cyclohexyl(methyl)amino]methyl]-5-(2-methylpropyl)imidazolidine-2,4-dione?
The InChIKey is JXTLHAUSYGRTSX-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H27N3O2/c1-11(2)9-13-14(19)18(15(20)16-13)10-17(3)12-7-5-4-6-8-12/h11-13H,4-10H2,1-3H3,(H,16,20)/t13-/m0/s1.
What are the key properties of (5S)-3-[[cyclohexyl(methyl)amino]methyl]-5-(2-methylpropyl)imidazolidine-2,4-dione?
(5S)-3-[[cyclohexyl(methyl)amino]methyl]-5-(2-methylpropyl)imidazolidine-2,4-dione has a molecular weight of 281.40 g/mol, XLogP of 2.17, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-3-[[cyclohexyl(methyl)amino]methyl]-5-(2-methylpropyl)imidazolidine-2,4-dione is sourced from PubChem (CID 41411898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).