2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)-N-(propylcarbamoyl)acetamide

C20H22N4O4 — CID 18777504

IUPAC2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)-N-(propylcarbamoyl)acetamide
SMILESCCCNC(=O)NC(=O)CN1C(=O)NC(C)(c2cccc3ccccc23)C1=O
InChIInChI=1S/C20H22N4O4/c1-3-11-21-18(27)22-16(25)12-24-17(26)20(2,23-19(24)28)15-10-6-8-13-7-4-5-9-14(13)15/h4-10H,3,11-12H2,1-2H3,(H,23,28)(H2,21,22,25,27)
InChIKeyPKBXQOLYOOTDSU-UHFFFAOYSA-N
MW382.42 g/mol
LogP1.84
Rot. Bonds5

About 2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)-N-(propylcarbamoyl)acetamide

2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)-N-(propylcarbamoyl)acetamide (PubChem CID 18777504) has the molecular formula C20H22N4O4 and a molecular weight of 382.42 g/mol. Its IUPAC name is 2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)-N-(propylcarbamoyl)acetamide.

Molecular Properties

Compound Name2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)-N-(propylcarbamoyl)acetamide
PubChem CID18777504
Molecular FormulaC20H22N4O4
Molecular Weight382.42 g/mol
Exact Mass382.16
IUPAC Name2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)-N-(propylcarbamoyl)acetamide
SMILESCCCNC(=O)NC(=O)CN1C(=O)NC(C)(c2cccc3ccccc23)C1=O
InChIInChI=1S/C20H22N4O4/c1-3-11-21-18(27)22-16(25)12-24-17(26)20(2,23-19(24)28)15-10-6-8-13-7-4-5-9-14(13)15/h4-10H,3,11-12H2,1-2H3,(H,23,28)(H2,21,22,25,27)
InChIKeyPKBXQOLYOOTDSU-UHFFFAOYSA-N
XLogP1.84
TPSA107.61 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.42
LogP ≤ 51.84
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)-N-(propylcarbamoyl)acetamide?
The IUPAC name of 2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)-N-(propylcarbamoyl)acetamide (CID 18777504) is 2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)-N-(propylcarbamoyl)acetamide.
What is the SMILES notation for 2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)-N-(propylcarbamoyl)acetamide?
The canonical SMILES for 2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)-N-(propylcarbamoyl)acetamide is CCCNC(=O)NC(=O)CN1C(=O)NC(C)(c2cccc3ccccc23)C1=O.
What is the InChIKey of 2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)-N-(propylcarbamoyl)acetamide?
The InChIKey is PKBXQOLYOOTDSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O4/c1-3-11-21-18(27)22-16(25)12-24-17(26)20(2,23-19(24)28)15-10-6-8-13-7-4-5-9-14(13)15/h4-10H,3,11-12H2,1-2H3,(H,23,28)(H2,21,22,25,27).
What are the key properties of 2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)-N-(propylcarbamoyl)acetamide?
2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)-N-(propylcarbamoyl)acetamide has a molecular weight of 382.42 g/mol, XLogP of 1.84, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl)-N-(propylcarbamoyl)acetamide is sourced from PubChem (CID 18777504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).