N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-4-[2-(3-methoxyanilino)-2-oxoethoxy]benzamide

C24H26N4O6 — CID 27532971

IUPACN-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-4-[2-(3-methoxyanilino)-2-oxoethoxy]benzamide
SMILESCOc1cccc(NC(=O)COc2ccc(C(=O)NN3C(=O)NC4(CCCCC4)C3=O)cc2)c1
InChIInChI=1S/C24H26N4O6/c1-33-19-7-5-6-17(14-19)25-20(29)15-34-18-10-8-16(9-11-18)21(30)27-28-22(31)24(26-23(28)32)12-3-2-4-13-24/h5-11,14H,2-4,12-13,15H2,1H3,(H,25,29)(H,26,32)(H,27,30)
InChIKeyCVMYAEKWVTVTBG-UHFFFAOYSA-N
MW466.49 g/mol
LogP2.61
Rot. Bonds7

About N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-4-[2-(3-methoxyanilino)-2-oxoethoxy]benzamide

N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-4-[2-(3-methoxyanilino)-2-oxoethoxy]benzamide (PubChem CID 27532971) has the molecular formula C24H26N4O6 and a molecular weight of 466.49 g/mol. Its IUPAC name is N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-4-[2-(3-methoxyanilino)-2-oxoethoxy]benzamide.

Molecular Properties

Compound NameN-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-4-[2-(3-methoxyanilino)-2-oxoethoxy]benzamide
PubChem CID27532971
Molecular FormulaC24H26N4O6
Molecular Weight466.49 g/mol
Exact Mass466.19
IUPAC NameN-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-4-[2-(3-methoxyanilino)-2-oxoethoxy]benzamide
SMILESCOc1cccc(NC(=O)COc2ccc(C(=O)NN3C(=O)NC4(CCCCC4)C3=O)cc2)c1
InChIInChI=1S/C24H26N4O6/c1-33-19-7-5-6-17(14-19)25-20(29)15-34-18-10-8-16(9-11-18)21(30)27-28-22(31)24(26-23(28)32)12-3-2-4-13-24/h5-11,14H,2-4,12-13,15H2,1H3,(H,25,29)(H,26,32)(H,27,30)
InChIKeyCVMYAEKWVTVTBG-UHFFFAOYSA-N
XLogP2.61
TPSA126.07 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500466.49
LogP ≤ 52.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

2-[4-(azocane-1-carbonyl)phenoxy]-N-(3-methoxyphenyl)acetamide
CID 51145616
4-[2-(3-methoxyanilino)-2-oxoethoxy]-N-pyrrolidin-3-ylbenzamide
CID 119452649
2-[4-[[(4-chlorobenzoyl)amino]carbamoyl]phenoxy]-N-(3-methoxyphenyl)acetamide
CID 55343241
2-(4-tert-butylphenoxy)-N-(3-methoxyphenyl)acetamide
CID 710366
N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-3,4,5-trimethoxybenzamide
CID 8873673
4-[2-(3-methoxyanilino)-2-oxoethoxy]-N-(2-phenoxyethyl)benzamide
CID 27758187
2-(3-methoxyphenoxy)-N-(3-methoxyphenyl)acetamide
CID 19204025
N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-2-[[5-(3-methoxyanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide
CID 16518875
ethyl 4-[4-[2-(3-methoxyanilino)-2-oxoethoxy]benzoyl]piperazine-1-carboxylate
CID 35508706
N-[3-(aminomethyl)pentan-3-yl]-4-[2-(3-methoxyanilino)-2-oxoethoxy]benzamide
CID 119570884
2-[4-[4-(cyclohexylmethyl)piperazine-1-carbonyl]phenoxy]-N-(3-methoxyphenyl)acetamide
CID 55987318
N-[(4-hydroxypyrrolidin-3-yl)methyl]-4-[2-(3-methoxyanilino)-2-oxoethoxy]benzamide;hydrochloride
CID 120945470

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-4-[2-(3-methoxyanilino)-2-oxoethoxy]benzamide?
The IUPAC name of N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-4-[2-(3-methoxyanilino)-2-oxoethoxy]benzamide (CID 27532971) is N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-4-[2-(3-methoxyanilino)-2-oxoethoxy]benzamide.
What is the SMILES notation for N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-4-[2-(3-methoxyanilino)-2-oxoethoxy]benzamide?
The canonical SMILES for N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-4-[2-(3-methoxyanilino)-2-oxoethoxy]benzamide is COc1cccc(NC(=O)COc2ccc(C(=O)NN3C(=O)NC4(CCCCC4)C3=O)cc2)c1.
What is the InChIKey of N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-4-[2-(3-methoxyanilino)-2-oxoethoxy]benzamide?
The InChIKey is CVMYAEKWVTVTBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N4O6/c1-33-19-7-5-6-17(14-19)25-20(29)15-34-18-10-8-16(9-11-18)21(30)27-28-22(31)24(26-23(28)32)12-3-2-4-13-24/h5-11,14H,2-4,12-13,15H2,1H3,(H,25,29)(H,26,32)(H,27,30).
What are the key properties of N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-4-[2-(3-methoxyanilino)-2-oxoethoxy]benzamide?
N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-4-[2-(3-methoxyanilino)-2-oxoethoxy]benzamide has a molecular weight of 466.49 g/mol, XLogP of 2.61, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-4-[2-(3-methoxyanilino)-2-oxoethoxy]benzamide is sourced from PubChem (CID 27532971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).