N-[dibutyl-[(4-methoxybenzoyl)amino]oxystannyl]oxy-4-methoxybenzamide

C24H34N2O6Sn — CID 16688892

IUPACN-[dibutyl-[(4-methoxybenzoyl)amino]oxystannyl]oxy-4-methoxybenzamide
SMILESCCCC[Sn](CCCC)(ONC(=O)c1ccc(OC)cc1)ONC(=O)c1ccc(OC)cc1
InChIInChI=1S/2C8H8NO3.2C4H9.Sn/c2*1-12-7-4-2-6(3-5-7)8(10)9-11;2*1-3-4-2;/h2*2-5H,1H3,(H-,9,10,11);2*1,3-4H2,2H3;/q2*-1;;;+2
InChIKeyLRSVNXPLLAUXEM-UHFFFAOYSA-N
MW565.26 g/mol
LogP4.77
Rot. Bonds14

About N-[dibutyl-[(4-methoxybenzoyl)amino]oxystannyl]oxy-4-methoxybenzamide

N-[dibutyl-[(4-methoxybenzoyl)amino]oxystannyl]oxy-4-methoxybenzamide (PubChem CID 16688892) has the molecular formula C24H34N2O6Sn and a molecular weight of 565.26 g/mol. Its IUPAC name is N-[dibutyl-[(4-methoxybenzoyl)amino]oxystannyl]oxy-4-methoxybenzamide.

Molecular Properties

Compound NameN-[dibutyl-[(4-methoxybenzoyl)amino]oxystannyl]oxy-4-methoxybenzamide
PubChem CID16688892
Molecular FormulaC24H34N2O6Sn
Molecular Weight565.26 g/mol
Exact Mass566.14
IUPAC NameN-[dibutyl-[(4-methoxybenzoyl)amino]oxystannyl]oxy-4-methoxybenzamide
SMILESCCCC[Sn](CCCC)(ONC(=O)c1ccc(OC)cc1)ONC(=O)c1ccc(OC)cc1
InChIInChI=1S/2C8H8NO3.2C4H9.Sn/c2*1-12-7-4-2-6(3-5-7)8(10)9-11;2*1-3-4-2;/h2*2-5H,1H3,(H-,9,10,11);2*1,3-4H2,2H3;/q2*-1;;;+2
InChIKeyLRSVNXPLLAUXEM-UHFFFAOYSA-N
XLogP4.77
TPSA95.12 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds14
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500565.26
LogP ≤ 54.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[dibutyl-(pyridine-4-carbonylamino)oxystannyl]oxypyridine-4-carboxamide
CID 16688159
4-methoxy-N-pentylbenzamide
CID 3113360
4-methoxy-N-nonylbenzamide
CID 3557385
N-hexyl-4-methoxy(11C)benzamide
CID 177422178
4-methoxy-N-pentanoylbenzamide
CID 175364766
2-amino-N-[[(2-aminobenzoyl)amino]oxy-dibutylstannyl]oxybenzamide
CID 16687745
N-[1-(butylamino)-3-methyl-1-oxobutan-2-yl]-4-methoxybenzamide
CID 3944138
N-[2-[(4-butoxybenzoyl)amino]phenyl]-4-methoxybenzamide
CID 10811951
N-[4-(butylamino)phenyl]-4-methoxybenzamide
CID 112980225
4-tributylstannylbenzohydrazide
CID 66858741
4-(aminomethyl)-N-[1-(4-methoxyphenyl)pentyl]benzamide
CID 119318120
tributyl-(4-methoxyphenyl)stannane
CID 2762547

Frequently Asked Questions

What is the IUPAC name of N-[dibutyl-[(4-methoxybenzoyl)amino]oxystannyl]oxy-4-methoxybenzamide?
The IUPAC name of N-[dibutyl-[(4-methoxybenzoyl)amino]oxystannyl]oxy-4-methoxybenzamide (CID 16688892) is N-[dibutyl-[(4-methoxybenzoyl)amino]oxystannyl]oxy-4-methoxybenzamide.
What is the SMILES notation for N-[dibutyl-[(4-methoxybenzoyl)amino]oxystannyl]oxy-4-methoxybenzamide?
The canonical SMILES for N-[dibutyl-[(4-methoxybenzoyl)amino]oxystannyl]oxy-4-methoxybenzamide is CCCC[Sn](CCCC)(ONC(=O)c1ccc(OC)cc1)ONC(=O)c1ccc(OC)cc1.
What is the InChIKey of N-[dibutyl-[(4-methoxybenzoyl)amino]oxystannyl]oxy-4-methoxybenzamide?
The InChIKey is LRSVNXPLLAUXEM-UHFFFAOYSA-N. The full InChI is InChI=1S/2C8H8NO3.2C4H9.Sn/c2*1-12-7-4-2-6(3-5-7)8(10)9-11;2*1-3-4-2;/h2*2-5H,1H3,(H-,9,10,11);2*1,3-4H2,2H3;/q2*-1;;;+2.
What are the key properties of N-[dibutyl-[(4-methoxybenzoyl)amino]oxystannyl]oxy-4-methoxybenzamide?
N-[dibutyl-[(4-methoxybenzoyl)amino]oxystannyl]oxy-4-methoxybenzamide has a molecular weight of 565.26 g/mol, XLogP of 4.77, 14 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[dibutyl-[(4-methoxybenzoyl)amino]oxystannyl]oxy-4-methoxybenzamide is sourced from PubChem (CID 16688892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).