2-(6-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-(2-phenylphenyl)acetamide

C23H25N3O3 — CID 4594879

IUPAC2-(6-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-(2-phenylphenyl)acetamide
SMILESCC1CCCCC12NC(=O)N(CC(=O)Nc1ccccc1-c1ccccc1)C2=O
InChIInChI=1S/C23H25N3O3/c1-16-9-7-8-14-23(16)21(28)26(22(29)25-23)15-20(27)24-19-13-6-5-12-18(19)17-10-3-2-4-11-17/h2-6,10-13,16H,7-9,14-15H2,1H3,(H,24,27)(H,25,29)
InChIKeyGSLTTYHVRMTKJG-UHFFFAOYSA-N
MW391.47 g/mol
LogP3.79
Rot. Bonds4

About 2-(6-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-(2-phenylphenyl)acetamide

2-(6-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-(2-phenylphenyl)acetamide (PubChem CID 4594879) has the molecular formula C23H25N3O3 and a molecular weight of 391.47 g/mol. Its IUPAC name is 2-(6-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-(2-phenylphenyl)acetamide.

Molecular Properties

Compound Name2-(6-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-(2-phenylphenyl)acetamide
PubChem CID4594879
Molecular FormulaC23H25N3O3
Molecular Weight391.47 g/mol
Exact Mass391.19
IUPAC Name2-(6-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-(2-phenylphenyl)acetamide
SMILESCC1CCCCC12NC(=O)N(CC(=O)Nc1ccccc1-c1ccccc1)C2=O
InChIInChI=1S/C23H25N3O3/c1-16-9-7-8-14-23(16)21(28)26(22(29)25-23)15-20(27)24-19-13-6-5-12-18(19)17-10-3-2-4-11-17/h2-6,10-13,16H,7-9,14-15H2,1H3,(H,24,27)(H,25,29)
InChIKeyGSLTTYHVRMTKJG-UHFFFAOYSA-N
XLogP3.79
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.47
LogP ≤ 53.79
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-(6-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-(2-phenylphenyl)acetamide?
The IUPAC name of 2-(6-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-(2-phenylphenyl)acetamide (CID 4594879) is 2-(6-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-(2-phenylphenyl)acetamide.
What is the SMILES notation for 2-(6-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-(2-phenylphenyl)acetamide?
The canonical SMILES for 2-(6-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-(2-phenylphenyl)acetamide is CC1CCCCC12NC(=O)N(CC(=O)Nc1ccccc1-c1ccccc1)C2=O.
What is the InChIKey of 2-(6-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-(2-phenylphenyl)acetamide?
The InChIKey is GSLTTYHVRMTKJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O3/c1-16-9-7-8-14-23(16)21(28)26(22(29)25-23)15-20(27)24-19-13-6-5-12-18(19)17-10-3-2-4-11-17/h2-6,10-13,16H,7-9,14-15H2,1H3,(H,24,27)(H,25,29).
What are the key properties of 2-(6-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-(2-phenylphenyl)acetamide?
2-(6-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-(2-phenylphenyl)acetamide has a molecular weight of 391.47 g/mol, XLogP of 3.79, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-N-(2-phenylphenyl)acetamide is sourced from PubChem (CID 4594879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).