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

C22H23N3O4 — CID 24661498

IUPAC2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-[2-(4-methylphenoxy)phenyl]acetamide
SMILESCc1ccc(Oc2ccccc2NC(=O)CN2C(=O)NC3(CCCC3)C2=O)cc1
InChIInChI=1S/C22H23N3O4/c1-15-8-10-16(11-9-15)29-18-7-3-2-6-17(18)23-19(26)14-25-20(27)22(24-21(25)28)12-4-5-13-22/h2-3,6-11H,4-5,12-14H2,1H3,(H,23,26)(H,24,28)
InChIKeyOPBGWPBOKJLEHV-UHFFFAOYSA-N
MW393.44 g/mol
LogP3.59
Rot. Bonds5

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

2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-[2-(4-methylphenoxy)phenyl]acetamide (PubChem CID 24661498) has the molecular formula C22H23N3O4 and a molecular weight of 393.44 g/mol. Its IUPAC name is 2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-[2-(4-methylphenoxy)phenyl]acetamide.

Molecular Properties

Compound Name2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-[2-(4-methylphenoxy)phenyl]acetamide
PubChem CID24661498
Molecular FormulaC22H23N3O4
Molecular Weight393.44 g/mol
Exact Mass393.17
IUPAC Name2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-[2-(4-methylphenoxy)phenyl]acetamide
SMILESCc1ccc(Oc2ccccc2NC(=O)CN2C(=O)NC3(CCCC3)C2=O)cc1
InChIInChI=1S/C22H23N3O4/c1-15-8-10-16(11-9-15)29-18-7-3-2-6-17(18)23-19(26)14-25-20(27)22(24-21(25)28)12-4-5-13-22/h2-3,6-11H,4-5,12-14H2,1H3,(H,23,26)(H,24,28)
InChIKeyOPBGWPBOKJLEHV-UHFFFAOYSA-N
XLogP3.59
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.44
LogP ≤ 53.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-[4-[4-(2-Methoxyphenyl)piperazin-1-yl]butyl]-3-methyl-5,5-diphenylimidazolidine-2,4-dione
CID 57384073
(5Z)-5-[(3-cyclopentyloxy-4-methoxyphenyl)methylidene]-3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]imidazolidine-2,4-dione
CID 155531753
2-(2-fluorophenyl)-N-[2-(2-methoxyanilino)-2-oxoethyl]-N-propylacetamide
CID 2525087
2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-(4-methoxyphenyl)acetamide
CID 2708830
Pyrrolidine-1,2-dicarboxylic acid 1-cyclohexylamide 2-[(2-methoxy-phenyl)-amide]
CID 3219731
N-ethyl-N-[2-(2-methoxyanilino)-2-oxoethyl]-3-phenylpropanamide
CID 4780403
N-(2-ethoxyphenyl)-2-[4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazin-1-yl]-2-phenylacetamide
CID 16291946
3-[[3-[[4-(2-Propan-2-yloxyphenyl)piperazin-1-yl]methyl]phenyl]methyl]imidazolidine-2,4-dione
CID 9932023
5-[[3-[[4-(2-Propan-2-yloxyphenyl)piperazin-1-yl]methyl]phenyl]methyl]imidazolidine-2,4-dione
CID 10598329
1-[[3-[[4-(2-Propan-2-yloxyphenyl)piperazin-1-yl]methyl]phenyl]methyl]imidazolidine-2,4-dione
CID 10622149
Pyrrolidine-1,2-dicarboxylic acid 2-benzylamide 1-[(2-methoxy-phenyl)-amide]
CID 644676
3-Benzyl-2-(2-methoxy-phenylamino)-3,5-dihydro-imidazol-4-one
CID 648663

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-[2-(4-methylphenoxy)phenyl]acetamide?
The IUPAC name of 2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-[2-(4-methylphenoxy)phenyl]acetamide (CID 24661498) is 2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-[2-(4-methylphenoxy)phenyl]acetamide.
What is the SMILES notation for 2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-[2-(4-methylphenoxy)phenyl]acetamide?
The canonical SMILES for 2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-[2-(4-methylphenoxy)phenyl]acetamide is Cc1ccc(Oc2ccccc2NC(=O)CN2C(=O)NC3(CCCC3)C2=O)cc1.
What is the InChIKey of 2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-[2-(4-methylphenoxy)phenyl]acetamide?
The InChIKey is OPBGWPBOKJLEHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O4/c1-15-8-10-16(11-9-15)29-18-7-3-2-6-17(18)23-19(26)14-25-20(27)22(24-21(25)28)12-4-5-13-22/h2-3,6-11H,4-5,12-14H2,1H3,(H,23,26)(H,24,28).
What are the key properties of 2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-[2-(4-methylphenoxy)phenyl]acetamide?
2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-[2-(4-methylphenoxy)phenyl]acetamide has a molecular weight of 393.44 g/mol, XLogP of 3.59, 5 rotatable bonds, 2 hydrogen bond donors, and 4 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-(4-methylphenoxy)phenyl]acetamide is sourced from PubChem (CID 24661498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).