(5S)-5-methyl-3-[[methyl(thiophen-3-ylmethyl)amino]methyl]-5-naphthalen-2-ylimidazolidine-2,4-dione

C21H21N3O2S — CID 9318878

IUPAC(5S)-5-methyl-3-[[methyl(thiophen-3-ylmethyl)amino]methyl]-5-naphthalen-2-ylimidazolidine-2,4-dione
SMILESCN(Cc1ccsc1)CN1C(=O)N[C@@](C)(c2ccc3ccccc3c2)C1=O
InChIInChI=1S/C21H21N3O2S/c1-21(18-8-7-16-5-3-4-6-17(16)11-18)19(25)24(20(26)22-21)14-23(2)12-15-9-10-27-13-15/h3-11,13H,12,14H2,1-2H3,(H,22,26)/t21-/m0/s1
InChIKeyHAZJVMPZNHCACD-NRFANRHFSA-N
MW379.49 g/mol
LogP3.76
Rot. Bonds5

About (5S)-5-methyl-3-[[methyl(thiophen-3-ylmethyl)amino]methyl]-5-naphthalen-2-ylimidazolidine-2,4-dione

(5S)-5-methyl-3-[[methyl(thiophen-3-ylmethyl)amino]methyl]-5-naphthalen-2-ylimidazolidine-2,4-dione (PubChem CID 9318878) has the molecular formula C21H21N3O2S and a molecular weight of 379.49 g/mol. Its IUPAC name is (5S)-5-methyl-3-[[methyl(thiophen-3-ylmethyl)amino]methyl]-5-naphthalen-2-ylimidazolidine-2,4-dione.

Molecular Properties

Compound Name(5S)-5-methyl-3-[[methyl(thiophen-3-ylmethyl)amino]methyl]-5-naphthalen-2-ylimidazolidine-2,4-dione
PubChem CID9318878
Molecular FormulaC21H21N3O2S
Molecular Weight379.49 g/mol
Exact Mass379.14
IUPAC Name(5S)-5-methyl-3-[[methyl(thiophen-3-ylmethyl)amino]methyl]-5-naphthalen-2-ylimidazolidine-2,4-dione
SMILESCN(Cc1ccsc1)CN1C(=O)N[C@@](C)(c2ccc3ccccc3c2)C1=O
InChIInChI=1S/C21H21N3O2S/c1-21(18-8-7-16-5-3-4-6-17(16)11-18)19(25)24(20(26)22-21)14-23(2)12-15-9-10-27-13-15/h3-11,13H,12,14H2,1-2H3,(H,22,26)/t21-/m0/s1
InChIKeyHAZJVMPZNHCACD-NRFANRHFSA-N
XLogP3.76
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.49
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze (5S)-5-methyl-3-[[methyl(thiophen-3-ylmethyl)amino]methyl]-5-naphthalen-2-ylimidazolidine-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

(5R)-5-(3-methoxyphenyl)-5-methyl-3-[[methyl(thiophen-3-ylmethyl)amino]methyl]imidazolidine-2,4-dione
CID 9318746
(5R)-5-methyl-3-[[methyl-[(4-piperidin-1-ylphenyl)methyl]amino]methyl]-5-naphthalen-2-ylimidazolidine-2,4-dione
CID 31388043
(5R)-5-methyl-3-[[methyl-[(2-piperidin-1-ylphenyl)methyl]amino]methyl]-5-naphthalen-2-ylimidazolidine-2,4-dione
CID 31388762
3-[[benzyl(methyl)amino]methyl]-5-methyl-5-phenylimidazolidine-2,4-dione
CID 4215276
2-[(4S)-4-methyl-4-naphthalen-2-yl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 2371043
N-[(6-methoxynaphthalen-2-yl)methyl]-N-methyl-2-(4-methyl-4-naphthalen-2-yl-2,5-dioxoimidazolidin-1-yl)acetamide
CID 55385186
N-[(4-fluorophenyl)methyl]-2-(4-methyl-4-naphthalen-2-yl-2,5-dioxoimidazolidin-1-yl)acetamide
CID 16546321
N-methyl-2-[4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]-N-(naphthalen-2-ylmethyl)acetamide
CID 46663971
5-methyl-5-naphthalen-2-yl-3-(2-propan-2-yloxyethyl)imidazolidine-2,4-dione
CID 24674252
(5R)-3-(1,3-benzothiazol-2-ylmethyl)-5-methyl-5-naphthalen-2-ylimidazolidine-2,4-dione
CID 9439740
2-[(4S)-4-methyl-4-naphthalen-2-yl-2,5-dioxoimidazolidin-1-yl]-N-(2-methylpropyl)acetamide
CID 51446549
(5R)-3-[[(5-bromothiophen-2-yl)methyl-methylamino]methyl]-5-methyl-5-phenylimidazolidine-2,4-dione
CID 9172206

Frequently Asked Questions

What is the IUPAC name of (5S)-5-methyl-3-[[methyl(thiophen-3-ylmethyl)amino]methyl]-5-naphthalen-2-ylimidazolidine-2,4-dione?
The IUPAC name of (5S)-5-methyl-3-[[methyl(thiophen-3-ylmethyl)amino]methyl]-5-naphthalen-2-ylimidazolidine-2,4-dione (CID 9318878) is (5S)-5-methyl-3-[[methyl(thiophen-3-ylmethyl)amino]methyl]-5-naphthalen-2-ylimidazolidine-2,4-dione.
What is the SMILES notation for (5S)-5-methyl-3-[[methyl(thiophen-3-ylmethyl)amino]methyl]-5-naphthalen-2-ylimidazolidine-2,4-dione?
The canonical SMILES for (5S)-5-methyl-3-[[methyl(thiophen-3-ylmethyl)amino]methyl]-5-naphthalen-2-ylimidazolidine-2,4-dione is CN(Cc1ccsc1)CN1C(=O)N[C@@](C)(c2ccc3ccccc3c2)C1=O.
What is the InChIKey of (5S)-5-methyl-3-[[methyl(thiophen-3-ylmethyl)amino]methyl]-5-naphthalen-2-ylimidazolidine-2,4-dione?
The InChIKey is HAZJVMPZNHCACD-NRFANRHFSA-N. The full InChI is InChI=1S/C21H21N3O2S/c1-21(18-8-7-16-5-3-4-6-17(16)11-18)19(25)24(20(26)22-21)14-23(2)12-15-9-10-27-13-15/h3-11,13H,12,14H2,1-2H3,(H,22,26)/t21-/m0/s1.
What are the key properties of (5S)-5-methyl-3-[[methyl(thiophen-3-ylmethyl)amino]methyl]-5-naphthalen-2-ylimidazolidine-2,4-dione?
(5S)-5-methyl-3-[[methyl(thiophen-3-ylmethyl)amino]methyl]-5-naphthalen-2-ylimidazolidine-2,4-dione has a molecular weight of 379.49 g/mol, XLogP of 3.76, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-5-methyl-3-[[methyl(thiophen-3-ylmethyl)amino]methyl]-5-naphthalen-2-ylimidazolidine-2,4-dione is sourced from PubChem (CID 9318878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).