N-(4-acetamidophenyl)-2-(2,4-dioxo-1,3-diazaspiro[4.7]dodecan-3-yl)acetamide

C20H26N4O4 — CID 2584000

IUPACN-(4-acetamidophenyl)-2-(2,4-dioxo-1,3-diazaspiro[4.7]dodecan-3-yl)acetamide
SMILESCC(=O)Nc1ccc(NC(=O)CN2C(=O)NC3(CCCCCCC3)C2=O)cc1
InChIInChI=1S/C20H26N4O4/c1-14(25)21-15-7-9-16(10-8-15)22-17(26)13-24-18(27)20(23-19(24)28)11-5-3-2-4-6-12-20/h7-10H,2-6,11-13H2,1H3,(H,21,25)(H,22,26)(H,23,28)
InChIKeyWYBGLVGRTVULIB-UHFFFAOYSA-N
MW386.45 g/mol
LogP2.62
Rot. Bonds4

About N-(4-acetamidophenyl)-2-(2,4-dioxo-1,3-diazaspiro[4.7]dodecan-3-yl)acetamide

N-(4-acetamidophenyl)-2-(2,4-dioxo-1,3-diazaspiro[4.7]dodecan-3-yl)acetamide (PubChem CID 2584000) has the molecular formula C20H26N4O4 and a molecular weight of 386.45 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-2-(2,4-dioxo-1,3-diazaspiro[4.7]dodecan-3-yl)acetamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-2-(2,4-dioxo-1,3-diazaspiro[4.7]dodecan-3-yl)acetamide
PubChem CID2584000
Molecular FormulaC20H26N4O4
Molecular Weight386.45 g/mol
Exact Mass386.20
IUPAC NameN-(4-acetamidophenyl)-2-(2,4-dioxo-1,3-diazaspiro[4.7]dodecan-3-yl)acetamide
SMILESCC(=O)Nc1ccc(NC(=O)CN2C(=O)NC3(CCCCCCC3)C2=O)cc1
InChIInChI=1S/C20H26N4O4/c1-14(25)21-15-7-9-16(10-8-15)22-17(26)13-24-18(27)20(23-19(24)28)11-5-3-2-4-6-12-20/h7-10H,2-6,11-13H2,1H3,(H,21,25)(H,22,26)(H,23,28)
InChIKeyWYBGLVGRTVULIB-UHFFFAOYSA-N
XLogP2.62
TPSA107.61 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.45
LogP ≤ 52.62
H-Bond Donors ≤ 53
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 N-(4-acetamidophenyl)-2-(2,4-dioxo-1,3-diazaspiro[4.7]dodecan-3-yl)acetamide?
The IUPAC name of N-(4-acetamidophenyl)-2-(2,4-dioxo-1,3-diazaspiro[4.7]dodecan-3-yl)acetamide (CID 2584000) is N-(4-acetamidophenyl)-2-(2,4-dioxo-1,3-diazaspiro[4.7]dodecan-3-yl)acetamide.
What is the SMILES notation for N-(4-acetamidophenyl)-2-(2,4-dioxo-1,3-diazaspiro[4.7]dodecan-3-yl)acetamide?
The canonical SMILES for N-(4-acetamidophenyl)-2-(2,4-dioxo-1,3-diazaspiro[4.7]dodecan-3-yl)acetamide is CC(=O)Nc1ccc(NC(=O)CN2C(=O)NC3(CCCCCCC3)C2=O)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-2-(2,4-dioxo-1,3-diazaspiro[4.7]dodecan-3-yl)acetamide?
The InChIKey is WYBGLVGRTVULIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O4/c1-14(25)21-15-7-9-16(10-8-15)22-17(26)13-24-18(27)20(23-19(24)28)11-5-3-2-4-6-12-20/h7-10H,2-6,11-13H2,1H3,(H,21,25)(H,22,26)(H,23,28).
What are the key properties of N-(4-acetamidophenyl)-2-(2,4-dioxo-1,3-diazaspiro[4.7]dodecan-3-yl)acetamide?
N-(4-acetamidophenyl)-2-(2,4-dioxo-1,3-diazaspiro[4.7]dodecan-3-yl)acetamide has a molecular weight of 386.45 g/mol, XLogP of 2.62, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-2-(2,4-dioxo-1,3-diazaspiro[4.7]dodecan-3-yl)acetamide is sourced from PubChem (CID 2584000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).