2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-[2-(3-methoxyphenoxy)-5-(trifluoromethyl)phenyl]acetamide

C23H22F3N3O5 — CID 26184587

IUPAC2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-[2-(3-methoxyphenoxy)-5-(trifluoromethyl)phenyl]acetamide
SMILESCOc1cccc(Oc2ccc(C(F)(F)F)cc2NC(=O)CN2C(=O)NC3(CCCC3)C2=O)c1
InChIInChI=1S/C23H22F3N3O5/c1-33-15-5-4-6-16(12-15)34-18-8-7-14(23(24,25)26)11-17(18)27-19(30)13-29-20(31)22(28-21(29)32)9-2-3-10-22/h4-8,11-12H,2-3,9-10,13H2,1H3,(H,27,30)(H,28,32)
InChIKeySGODTBGVSLDEBK-UHFFFAOYSA-N
MW477.44 g/mol
LogP4.31
Rot. Bonds6

About 2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-[2-(3-methoxyphenoxy)-5-(trifluoromethyl)phenyl]acetamide

2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-[2-(3-methoxyphenoxy)-5-(trifluoromethyl)phenyl]acetamide (PubChem CID 26184587) has the molecular formula C23H22F3N3O5 and a molecular weight of 477.44 g/mol. Its IUPAC name is 2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-[2-(3-methoxyphenoxy)-5-(trifluoromethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-[2-(3-methoxyphenoxy)-5-(trifluoromethyl)phenyl]acetamide
PubChem CID26184587
Molecular FormulaC23H22F3N3O5
Molecular Weight477.44 g/mol
Exact Mass477.15
IUPAC Name2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-[2-(3-methoxyphenoxy)-5-(trifluoromethyl)phenyl]acetamide
SMILESCOc1cccc(Oc2ccc(C(F)(F)F)cc2NC(=O)CN2C(=O)NC3(CCCC3)C2=O)c1
InChIInChI=1S/C23H22F3N3O5/c1-33-15-5-4-6-16(12-15)34-18-8-7-14(23(24,25)26)11-17(18)27-19(30)13-29-20(31)22(28-21(29)32)9-2-3-10-22/h4-8,11-12H,2-3,9-10,13H2,1H3,(H,27,30)(H,28,32)
InChIKeySGODTBGVSLDEBK-UHFFFAOYSA-N
XLogP4.31
TPSA96.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500477.44
LogP ≤ 54.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-[2-(3-methoxyphenoxy)-5-(trifluoromethyl)phenyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-[2-(3-methoxyphenoxy)-5-(trifluoromethyl)phenyl]acetamide?
The IUPAC name of 2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-[2-(3-methoxyphenoxy)-5-(trifluoromethyl)phenyl]acetamide (CID 26184587) is 2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-[2-(3-methoxyphenoxy)-5-(trifluoromethyl)phenyl]acetamide.
What is the SMILES notation for 2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-[2-(3-methoxyphenoxy)-5-(trifluoromethyl)phenyl]acetamide?
The canonical SMILES for 2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-[2-(3-methoxyphenoxy)-5-(trifluoromethyl)phenyl]acetamide is COc1cccc(Oc2ccc(C(F)(F)F)cc2NC(=O)CN2C(=O)NC3(CCCC3)C2=O)c1.
What is the InChIKey of 2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-[2-(3-methoxyphenoxy)-5-(trifluoromethyl)phenyl]acetamide?
The InChIKey is SGODTBGVSLDEBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22F3N3O5/c1-33-15-5-4-6-16(12-15)34-18-8-7-14(23(24,25)26)11-17(18)27-19(30)13-29-20(31)22(28-21(29)32)9-2-3-10-22/h4-8,11-12H,2-3,9-10,13H2,1H3,(H,27,30)(H,28,32).
What are the key properties of 2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-[2-(3-methoxyphenoxy)-5-(trifluoromethyl)phenyl]acetamide?
2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-[2-(3-methoxyphenoxy)-5-(trifluoromethyl)phenyl]acetamide has a molecular weight of 477.44 g/mol, XLogP of 4.31, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-[2-(3-methoxyphenoxy)-5-(trifluoromethyl)phenyl]acetamide is sourced from PubChem (CID 26184587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).