2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-(3-methoxyphenyl)acetamide

C18H25N3O4 — CID 2089356

IUPAC2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-(3-methoxyphenyl)acetamide
SMILESCCCC1(CCC)NC(=O)N(CC(=O)Nc2cccc(OC)c2)C1=O
InChIInChI=1S/C18H25N3O4/c1-4-9-18(10-5-2)16(23)21(17(24)20-18)12-15(22)19-13-7-6-8-14(11-13)25-3/h6-8,11H,4-5,9-10,12H2,1-3H3,(H,19,22)(H,20,24)
InChIKeyBSCJGOVRDFHXFF-UHFFFAOYSA-N
MW347.42 g/mol
LogP2.52
Rot. Bonds8

About 2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-(3-methoxyphenyl)acetamide

2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-(3-methoxyphenyl)acetamide (PubChem CID 2089356) has the molecular formula C18H25N3O4 and a molecular weight of 347.42 g/mol. Its IUPAC name is 2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-(3-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-(3-methoxyphenyl)acetamide
PubChem CID2089356
Molecular FormulaC18H25N3O4
Molecular Weight347.42 g/mol
Exact Mass347.18
IUPAC Name2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-(3-methoxyphenyl)acetamide
SMILESCCCC1(CCC)NC(=O)N(CC(=O)Nc2cccc(OC)c2)C1=O
InChIInChI=1S/C18H25N3O4/c1-4-9-18(10-5-2)16(23)21(17(24)20-18)12-15(22)19-13-7-6-8-14(11-13)25-3/h6-8,11H,4-5,9-10,12H2,1-3H3,(H,19,22)(H,20,24)
InChIKeyBSCJGOVRDFHXFF-UHFFFAOYSA-N
XLogP2.52
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.42
LogP ≤ 52.52
H-Bond Donors ≤ 52
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-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-(3-methoxyphenyl)acetamide?
The IUPAC name of 2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-(3-methoxyphenyl)acetamide (CID 2089356) is 2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-(3-methoxyphenyl)acetamide.
What is the SMILES notation for 2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-(3-methoxyphenyl)acetamide?
The canonical SMILES for 2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-(3-methoxyphenyl)acetamide is CCCC1(CCC)NC(=O)N(CC(=O)Nc2cccc(OC)c2)C1=O.
What is the InChIKey of 2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-(3-methoxyphenyl)acetamide?
The InChIKey is BSCJGOVRDFHXFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O4/c1-4-9-18(10-5-2)16(23)21(17(24)20-18)12-15(22)19-13-7-6-8-14(11-13)25-3/h6-8,11H,4-5,9-10,12H2,1-3H3,(H,19,22)(H,20,24).
What are the key properties of 2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-(3-methoxyphenyl)acetamide?
2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-(3-methoxyphenyl)acetamide has a molecular weight of 347.42 g/mol, XLogP of 2.52, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-(3-methoxyphenyl)acetamide is sourced from PubChem (CID 2089356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).