2-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide

C20H25N3O3 — CID 55340063

IUPAC2-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide
SMILESO=C(CN1C(=O)NC2(CCCCC2)C1=O)NC1CCc2ccccc2C1
InChIInChI=1S/C20H25N3O3/c24-17(21-16-9-8-14-6-2-3-7-15(14)12-16)13-23-18(25)20(22-19(23)26)10-4-1-5-11-20/h2-3,6-7,16H,1,4-5,8-13H2,(H,21,24)(H,22,26)
InChIKeyMHXZMXBPPLFTDW-UHFFFAOYSA-N
MW355.44 g/mol
LogP1.91
Rot. Bonds3

About 2-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide

2-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide (PubChem CID 55340063) has the molecular formula C20H25N3O3 and a molecular weight of 355.44 g/mol. Its IUPAC name is 2-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide.

Molecular Properties

Compound Name2-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide
PubChem CID55340063
Molecular FormulaC20H25N3O3
Molecular Weight355.44 g/mol
Exact Mass355.19
IUPAC Name2-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide
SMILESO=C(CN1C(=O)NC2(CCCCC2)C1=O)NC1CCc2ccccc2C1
InChIInChI=1S/C20H25N3O3/c24-17(21-16-9-8-14-6-2-3-7-15(14)12-16)13-23-18(25)20(22-19(23)26)10-4-1-5-11-20/h2-3,6-7,16H,1,4-5,8-13H2,(H,21,24)(H,22,26)
InChIKeyMHXZMXBPPLFTDW-UHFFFAOYSA-N
XLogP1.91
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 51.91
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-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide?
The IUPAC name of 2-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide (CID 55340063) is 2-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide.
What is the SMILES notation for 2-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide?
The canonical SMILES for 2-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide is O=C(CN1C(=O)NC2(CCCCC2)C1=O)NC1CCc2ccccc2C1.
What is the InChIKey of 2-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide?
The InChIKey is MHXZMXBPPLFTDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O3/c24-17(21-16-9-8-14-6-2-3-7-15(14)12-16)13-23-18(25)20(22-19(23)26)10-4-1-5-11-20/h2-3,6-7,16H,1,4-5,8-13H2,(H,21,24)(H,22,26).
What are the key properties of 2-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide?
2-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide has a molecular weight of 355.44 g/mol, XLogP of 1.91, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)acetamide is sourced from PubChem (CID 55340063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).