3-[2-[benzyl(furan-2-ylmethyl)amino]ethyl]-5,5-dimethylimidazolidine-2,4-dione

C19H23N3O3 — CID 34185684

IUPAC3-[2-[benzyl(furan-2-ylmethyl)amino]ethyl]-5,5-dimethylimidazolidine-2,4-dione
SMILESCC1(C)NC(=O)N(CCN(Cc2ccccc2)Cc2ccco2)C1=O
InChIInChI=1S/C19H23N3O3/c1-19(2)17(23)22(18(24)20-19)11-10-21(14-16-9-6-12-25-16)13-15-7-4-3-5-8-15/h3-9,12H,10-11,13-14H2,1-2H3,(H,20,24)
InChIKeyPNRVGYNESQSGSG-UHFFFAOYSA-N
MW341.41 g/mol
LogP2.61
Rot. Bonds7

About 3-[2-[benzyl(furan-2-ylmethyl)amino]ethyl]-5,5-dimethylimidazolidine-2,4-dione

3-[2-[benzyl(furan-2-ylmethyl)amino]ethyl]-5,5-dimethylimidazolidine-2,4-dione (PubChem CID 34185684) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is 3-[2-[benzyl(furan-2-ylmethyl)amino]ethyl]-5,5-dimethylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-[2-[benzyl(furan-2-ylmethyl)amino]ethyl]-5,5-dimethylimidazolidine-2,4-dione
PubChem CID34185684
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC Name3-[2-[benzyl(furan-2-ylmethyl)amino]ethyl]-5,5-dimethylimidazolidine-2,4-dione
SMILESCC1(C)NC(=O)N(CCN(Cc2ccccc2)Cc2ccco2)C1=O
InChIInChI=1S/C19H23N3O3/c1-19(2)17(23)22(18(24)20-19)11-10-21(14-16-9-6-12-25-16)13-15-7-4-3-5-8-15/h3-9,12H,10-11,13-14H2,1-2H3,(H,20,24)
InChIKeyPNRVGYNESQSGSG-UHFFFAOYSA-N
XLogP2.61
TPSA65.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 3-[2-[benzyl(furan-2-ylmethyl)amino]ethyl]-5,5-dimethylimidazolidine-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,N-bis(furan-2-ylmethyl)-1-phenylmethanamine
CID 10825735
4-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(furan-2-ylmethyl)-N-methylbutanamide
CID 18109840
3-[2-[benzhydryl(methyl)amino]ethyl]-5,5-dimethylimidazolidine-2,4-dione
CID 35429502
3-[2-[(3-chlorophenyl)methyl-methylamino]ethyl]-5,5-dimethylimidazolidine-2,4-dione
CID 35429756
3-[2-[(2-methoxyphenyl)methyl-(thiophen-2-ylmethyl)amino]ethyl]-5,5-dimethylimidazolidine-2,4-dione
CID 34185346
3-[2-[(5-chlorothiophen-2-yl)methyl-ethylamino]ethyl]-5,5-dimethylimidazolidine-2,4-dione
CID 86927868
2-[2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)ethyl-propylamino]acetic acid
CID 61007896
3-(2-amino-4-phenylbutyl)-5,5-dimethylimidazolidine-2,4-dione;ethane
CID 142089489
5,5-dimethyl-3-[3-[methyl-[(4-methylphenyl)methyl]amino]propyl]imidazolidine-2,4-dione
CID 87013212
3-[benzyl(furan-2-ylmethyl)amino]-N-carbamoylpropanamide
CID 18126981
3-[5-[[benzyl(furan-2-ylmethyl)amino]methyl]furan-2-yl]pentan-3-ol
CID 46014026
(5R)-3-benzyl-5-(furan-2-yl)-5-methylimidazolidine-2,4-dione
CID 51462112

Frequently Asked Questions

What is the IUPAC name of 3-[2-[benzyl(furan-2-ylmethyl)amino]ethyl]-5,5-dimethylimidazolidine-2,4-dione?
The IUPAC name of 3-[2-[benzyl(furan-2-ylmethyl)amino]ethyl]-5,5-dimethylimidazolidine-2,4-dione (CID 34185684) is 3-[2-[benzyl(furan-2-ylmethyl)amino]ethyl]-5,5-dimethylimidazolidine-2,4-dione.
What is the SMILES notation for 3-[2-[benzyl(furan-2-ylmethyl)amino]ethyl]-5,5-dimethylimidazolidine-2,4-dione?
The canonical SMILES for 3-[2-[benzyl(furan-2-ylmethyl)amino]ethyl]-5,5-dimethylimidazolidine-2,4-dione is CC1(C)NC(=O)N(CCN(Cc2ccccc2)Cc2ccco2)C1=O.
What is the InChIKey of 3-[2-[benzyl(furan-2-ylmethyl)amino]ethyl]-5,5-dimethylimidazolidine-2,4-dione?
The InChIKey is PNRVGYNESQSGSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-19(2)17(23)22(18(24)20-19)11-10-21(14-16-9-6-12-25-16)13-15-7-4-3-5-8-15/h3-9,12H,10-11,13-14H2,1-2H3,(H,20,24).
What are the key properties of 3-[2-[benzyl(furan-2-ylmethyl)amino]ethyl]-5,5-dimethylimidazolidine-2,4-dione?
3-[2-[benzyl(furan-2-ylmethyl)amino]ethyl]-5,5-dimethylimidazolidine-2,4-dione has a molecular weight of 341.41 g/mol, XLogP of 2.61, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-[benzyl(furan-2-ylmethyl)amino]ethyl]-5,5-dimethylimidazolidine-2,4-dione is sourced from PubChem (CID 34185684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).