N-(2,3-dihydro-1H-inden-5-yl)-2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide

C20H25N3O3 — CID 2523900

IUPACN-(2,3-dihydro-1H-inden-5-yl)-2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide
SMILESCC1CCC2(CC1)NC(=O)N(CC(=O)Nc1ccc3c(c1)CCC3)C2=O
InChIInChI=1S/C20H25N3O3/c1-13-7-9-20(10-8-13)18(25)23(19(26)22-20)12-17(24)21-16-6-5-14-3-2-4-15(14)11-16/h5-6,11,13H,2-4,7-10,12H2,1H3,(H,21,24)(H,22,26)
InChIKeyHWUPPQGLMFAZNW-UHFFFAOYSA-N
MW355.44 g/mol
LogP2.61
Rot. Bonds3

About N-(2,3-dihydro-1H-inden-5-yl)-2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide

N-(2,3-dihydro-1H-inden-5-yl)-2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide (PubChem CID 2523900) has the molecular formula C20H25N3O3 and a molecular weight of 355.44 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-inden-5-yl)-2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-inden-5-yl)-2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide
PubChem CID2523900
Molecular FormulaC20H25N3O3
Molecular Weight355.44 g/mol
Exact Mass355.19
IUPAC NameN-(2,3-dihydro-1H-inden-5-yl)-2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide
SMILESCC1CCC2(CC1)NC(=O)N(CC(=O)Nc1ccc3c(c1)CCC3)C2=O
InChIInChI=1S/C20H25N3O3/c1-13-7-9-20(10-8-13)18(25)23(19(26)22-20)12-17(24)21-16-6-5-14-3-2-4-15(14)11-16/h5-6,11,13H,2-4,7-10,12H2,1H3,(H,21,24)(H,22,26)
InChIKeyHWUPPQGLMFAZNW-UHFFFAOYSA-N
XLogP2.61
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 ≤ 52.61
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 N-(2,3-dihydro-1H-inden-5-yl)-2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide?
The IUPAC name of N-(2,3-dihydro-1H-inden-5-yl)-2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide (CID 2523900) is N-(2,3-dihydro-1H-inden-5-yl)-2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide.
What is the SMILES notation for N-(2,3-dihydro-1H-inden-5-yl)-2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide?
The canonical SMILES for N-(2,3-dihydro-1H-inden-5-yl)-2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide is CC1CCC2(CC1)NC(=O)N(CC(=O)Nc1ccc3c(c1)CCC3)C2=O.
What is the InChIKey of N-(2,3-dihydro-1H-inden-5-yl)-2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide?
The InChIKey is HWUPPQGLMFAZNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O3/c1-13-7-9-20(10-8-13)18(25)23(19(26)22-20)12-17(24)21-16-6-5-14-3-2-4-15(14)11-16/h5-6,11,13H,2-4,7-10,12H2,1H3,(H,21,24)(H,22,26).
What are the key properties of N-(2,3-dihydro-1H-inden-5-yl)-2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide?
N-(2,3-dihydro-1H-inden-5-yl)-2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide has a molecular weight of 355.44 g/mol, XLogP of 2.61, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-inden-5-yl)-2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide is sourced from PubChem (CID 2523900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).