5-[2-methyl-4,5-bis(trimethylsilyl)phenoxy]-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide

C27H37NO6Si2 — CID 11329981

IUPAC5-[2-methyl-4,5-bis(trimethylsilyl)phenoxy]-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide
SMILESCOc1cc(OC)c(NC(=O)c2ccc(Oc3cc([Si](C)(C)C)c([Si](C)(C)C)cc3C)o2)c(OC)c1
InChIInChI=1S/C27H37NO6Si2/c1-17-13-23(35(5,6)7)24(36(8,9)10)16-20(17)34-25-12-11-19(33-25)27(29)28-26-21(31-3)14-18(30-2)15-22(26)32-4/h11-16H,1-10H3,(H,28,29)
InChIKeyCEBSMZDZWWCYHR-UHFFFAOYSA-N
MW527.77 g/mol
LogP5.75
Rot. Bonds9

About 5-[2-methyl-4,5-bis(trimethylsilyl)phenoxy]-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide

5-[2-methyl-4,5-bis(trimethylsilyl)phenoxy]-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide (PubChem CID 11329981) has the molecular formula C27H37NO6Si2 and a molecular weight of 527.77 g/mol. Its IUPAC name is 5-[2-methyl-4,5-bis(trimethylsilyl)phenoxy]-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-[2-methyl-4,5-bis(trimethylsilyl)phenoxy]-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide
PubChem CID11329981
Molecular FormulaC27H37NO6Si2
Molecular Weight527.77 g/mol
Exact Mass527.22
IUPAC Name5-[2-methyl-4,5-bis(trimethylsilyl)phenoxy]-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide
SMILESCOc1cc(OC)c(NC(=O)c2ccc(Oc3cc([Si](C)(C)C)c([Si](C)(C)C)cc3C)o2)c(OC)c1
InChIInChI=1S/C27H37NO6Si2/c1-17-13-23(35(5,6)7)24(36(8,9)10)16-20(17)34-25-12-11-19(33-25)27(29)28-26-21(31-3)14-18(30-2)15-22(26)32-4/h11-16H,1-10H3,(H,28,29)
InChIKeyCEBSMZDZWWCYHR-UHFFFAOYSA-N
XLogP5.75
TPSA79.16 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms36
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500527.77
LogP ≤ 55.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 5-[2-methyl-4,5-bis(trimethylsilyl)phenoxy]-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-(2-methoxy-5-trimethylsilylphenoxy)-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide
CID 11236781
N-(2,4,6-trimethoxyphenyl)-5-[(1,1,5-trimethyl-2,3-dihydro-1-benzosilol-6-yl)oxy]furan-2-carboxamide
CID 11294292
N-(2,4,6-trimethoxyphenyl)-5-[(1,1,6-trimethyl-2,3-dihydro-1-benzosilol-5-yl)oxy]furan-2-carboxamide
CID 58877586
5-[4-[2,2-dimethylpropyl(dimethyl)silyl]-2-methylphenoxy]-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide
CID 11260771
5-quinolin-8-yloxy-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide
CID 10273631
N-(2,6-dimethoxyphenyl)-5-[(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)oxy]furan-2-carboxamide
CID 10139658
5-(3-piperidin-4-ylphenoxy)-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide
CID 10182522
N-(2,4,6-trimethoxyphenyl)-5-[(2,4,6-trimethoxyphenyl)methyl]furan-2-carboxamide
CID 21047128
N-[4-(2-(19F)fluoroethylamino)-2,6-dimethoxyphenyl]-5-[(3,3,6-trimethyl-1,2-dihydroinden-5-yl)oxy]furan-2-carboxamide
CID 86293113
N-(2,6-dimethoxy-4-methylphenyl)-5-(2-methyl-6-propylphenoxy)furan-2-carboxamide
CID 142192176
5-[(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)sulfanyl]-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide
CID 10301106
N-[4,6-dimethoxy-2-(methylamino)pyrimidin-5-yl]-5-[(3,3,6-trimethyl-1,2-dihydroinden-5-yl)oxy]furan-2-carboxamide
CID 166167909

Frequently Asked Questions

What is the IUPAC name of 5-[2-methyl-4,5-bis(trimethylsilyl)phenoxy]-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide?
The IUPAC name of 5-[2-methyl-4,5-bis(trimethylsilyl)phenoxy]-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide (CID 11329981) is 5-[2-methyl-4,5-bis(trimethylsilyl)phenoxy]-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide.
What is the SMILES notation for 5-[2-methyl-4,5-bis(trimethylsilyl)phenoxy]-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide?
The canonical SMILES for 5-[2-methyl-4,5-bis(trimethylsilyl)phenoxy]-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide is COc1cc(OC)c(NC(=O)c2ccc(Oc3cc([Si](C)(C)C)c([Si](C)(C)C)cc3C)o2)c(OC)c1.
What is the InChIKey of 5-[2-methyl-4,5-bis(trimethylsilyl)phenoxy]-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide?
The InChIKey is CEBSMZDZWWCYHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H37NO6Si2/c1-17-13-23(35(5,6)7)24(36(8,9)10)16-20(17)34-25-12-11-19(33-25)27(29)28-26-21(31-3)14-18(30-2)15-22(26)32-4/h11-16H,1-10H3,(H,28,29).
What are the key properties of 5-[2-methyl-4,5-bis(trimethylsilyl)phenoxy]-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide?
5-[2-methyl-4,5-bis(trimethylsilyl)phenoxy]-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide has a molecular weight of 527.77 g/mol, XLogP of 5.75, 9 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-methyl-4,5-bis(trimethylsilyl)phenoxy]-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide is sourced from PubChem (CID 11329981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).