N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-3,4,5-trimethoxybenzamide

C18H23N3O6 — CID 8873673

IUPACN-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-3,4,5-trimethoxybenzamide
SMILESCOc1cc(C(=O)NN2C(=O)NC3(CCCCC3)C2=O)cc(OC)c1OC
InChIInChI=1S/C18H23N3O6/c1-25-12-9-11(10-13(26-2)14(12)27-3)15(22)20-21-16(23)18(19-17(21)24)7-5-4-6-8-18/h9-10H,4-8H2,1-3H3,(H,19,24)(H,20,22)
InChIKeyVOGNTSQRORASIL-UHFFFAOYSA-N
MW377.40 g/mol
LogP1.61
Rot. Bonds5

About N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-3,4,5-trimethoxybenzamide

N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-3,4,5-trimethoxybenzamide (PubChem CID 8873673) has the molecular formula C18H23N3O6 and a molecular weight of 377.40 g/mol. Its IUPAC name is N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-3,4,5-trimethoxybenzamide.

Molecular Properties

Compound NameN-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-3,4,5-trimethoxybenzamide
PubChem CID8873673
Molecular FormulaC18H23N3O6
Molecular Weight377.40 g/mol
Exact Mass377.16
IUPAC NameN-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-3,4,5-trimethoxybenzamide
SMILESCOc1cc(C(=O)NN2C(=O)NC3(CCCCC3)C2=O)cc(OC)c1OC
InChIInChI=1S/C18H23N3O6/c1-25-12-9-11(10-13(26-2)14(12)27-3)15(22)20-21-16(23)18(19-17(21)24)7-5-4-6-8-18/h9-10H,4-8H2,1-3H3,(H,19,24)(H,20,22)
InChIKeyVOGNTSQRORASIL-UHFFFAOYSA-N
XLogP1.61
TPSA106.20 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.40
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

3-chloro-N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-4,5-dimethoxybenzamide
CID 27532791
4-butoxy-N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-3-methoxybenzamide
CID 18268474
N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)naphthalene-2-carboxamide
CID 8873669
3-chloro-4,5-dimethoxy-N-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)benzamide
CID 52990929
N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-2-(2-methoxy-5-methylanilino)acetamide
CID 27056892
2-(5-chloro-2-methoxyanilino)-N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide
CID 24533725
N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-4-[2-(3-methoxyanilino)-2-oxoethoxy]benzamide
CID 27532971
N-(1,3-dioxoisoindol-2-yl)-3,4,5-trimethoxybenzamide
CID 1008664
N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-2-(2-methoxy-5-nitrophenoxy)acetamide
CID 24557174
[2-[(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)amino]-2-oxoethyl] 2-methoxybenzoate
CID 7891326
6-methoxy-N-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)pyridine-3-carboxamide
CID 24545842
1-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-3-(2-methoxyethyl)thiourea
CID 8766476

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-3,4,5-trimethoxybenzamide?
The IUPAC name of N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-3,4,5-trimethoxybenzamide (CID 8873673) is N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-3,4,5-trimethoxybenzamide.
What is the SMILES notation for N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-3,4,5-trimethoxybenzamide?
The canonical SMILES for N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-3,4,5-trimethoxybenzamide is COc1cc(C(=O)NN2C(=O)NC3(CCCCC3)C2=O)cc(OC)c1OC.
What is the InChIKey of N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-3,4,5-trimethoxybenzamide?
The InChIKey is VOGNTSQRORASIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O6/c1-25-12-9-11(10-13(26-2)14(12)27-3)15(22)20-21-16(23)18(19-17(21)24)7-5-4-6-8-18/h9-10H,4-8H2,1-3H3,(H,19,24)(H,20,22).
What are the key properties of N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-3,4,5-trimethoxybenzamide?
N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)-3,4,5-trimethoxybenzamide has a molecular weight of 377.40 g/mol, XLogP of 1.61, 5 rotatable bonds, 2 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)-3,4,5-trimethoxybenzamide is sourced from PubChem (CID 8873673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).