2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-naphthalen-1-ylacetamide

C19H21N3O3 — CID 2106714

IUPAC2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-naphthalen-1-ylacetamide
SMILESCCC1(CC)NC(=O)N(CC(=O)Nc2cccc3ccccc23)C1=O
InChIInChI=1S/C19H21N3O3/c1-3-19(4-2)17(24)22(18(25)21-19)12-16(23)20-15-11-7-9-13-8-5-6-10-14(13)15/h5-11H,3-4,12H2,1-2H3,(H,20,23)(H,21,25)
InChIKeyPTVSDKBSPVVVIL-UHFFFAOYSA-N
MW339.39 g/mol
LogP2.89
Rot. Bonds5

About 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-naphthalen-1-ylacetamide

2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-naphthalen-1-ylacetamide (PubChem CID 2106714) has the molecular formula C19H21N3O3 and a molecular weight of 339.39 g/mol. Its IUPAC name is 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-naphthalen-1-ylacetamide.

Molecular Properties

Compound Name2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-naphthalen-1-ylacetamide
PubChem CID2106714
Molecular FormulaC19H21N3O3
Molecular Weight339.39 g/mol
Exact Mass339.16
IUPAC Name2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-naphthalen-1-ylacetamide
SMILESCCC1(CC)NC(=O)N(CC(=O)Nc2cccc3ccccc23)C1=O
InChIInChI=1S/C19H21N3O3/c1-3-19(4-2)17(24)22(18(25)21-19)12-16(23)20-15-11-7-9-13-8-5-6-10-14(13)15/h5-11H,3-4,12H2,1-2H3,(H,20,23)(H,21,25)
InChIKeyPTVSDKBSPVVVIL-UHFFFAOYSA-N
XLogP2.89
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.39
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-naphthalen-1-ylacetamide?
The IUPAC name of 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-naphthalen-1-ylacetamide (CID 2106714) is 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-naphthalen-1-ylacetamide.
What is the SMILES notation for 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-naphthalen-1-ylacetamide?
The canonical SMILES for 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-naphthalen-1-ylacetamide is CCC1(CC)NC(=O)N(CC(=O)Nc2cccc3ccccc23)C1=O.
What is the InChIKey of 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-naphthalen-1-ylacetamide?
The InChIKey is PTVSDKBSPVVVIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O3/c1-3-19(4-2)17(24)22(18(25)21-19)12-16(23)20-15-11-7-9-13-8-5-6-10-14(13)15/h5-11H,3-4,12H2,1-2H3,(H,20,23)(H,21,25).
What are the key properties of 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-naphthalen-1-ylacetamide?
2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-naphthalen-1-ylacetamide has a molecular weight of 339.39 g/mol, XLogP of 2.89, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-naphthalen-1-ylacetamide is sourced from PubChem (CID 2106714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).