5-(2-methoxy-5-trimethylsilylphenoxy)-3-oxo-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide

C24H29NO8Si — CID 69371762

IUPAC5-(2-methoxy-5-trimethylsilylphenoxy)-3-oxo-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide
SMILESCOc1cc(OC)c(NC(=O)C2OC(Oc3cc([Si](C)(C)C)ccc3OC)=CC2=O)c(OC)c1
InChIInChI=1S/C24H29NO8Si/c1-28-14-10-19(30-3)22(20(11-14)31-4)25-24(27)23-16(26)13-21(33-23)32-18-12-15(34(5,6)7)8-9-17(18)29-2/h8-13,23H,1-7H3,(H,25,27)
InChIKeyHMPWJWYJLPQABO-UHFFFAOYSA-N
MW487.58 g/mol
LogP3.09
Rot. Bonds9

About 5-(2-methoxy-5-trimethylsilylphenoxy)-3-oxo-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide

5-(2-methoxy-5-trimethylsilylphenoxy)-3-oxo-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide (PubChem CID 69371762) has the molecular formula C24H29NO8Si and a molecular weight of 487.58 g/mol. Its IUPAC name is 5-(2-methoxy-5-trimethylsilylphenoxy)-3-oxo-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-(2-methoxy-5-trimethylsilylphenoxy)-3-oxo-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide
PubChem CID69371762
Molecular FormulaC24H29NO8Si
Molecular Weight487.58 g/mol
Exact Mass487.17
IUPAC Name5-(2-methoxy-5-trimethylsilylphenoxy)-3-oxo-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide
SMILESCOc1cc(OC)c(NC(=O)C2OC(Oc3cc([Si](C)(C)C)ccc3OC)=CC2=O)c(OC)c1
InChIInChI=1S/C24H29NO8Si/c1-28-14-10-19(30-3)22(20(11-14)31-4)25-24(27)23-16(26)13-21(33-23)32-18-12-15(34(5,6)7)8-9-17(18)29-2/h8-13,23H,1-7H3,(H,25,27)
InChIKeyHMPWJWYJLPQABO-UHFFFAOYSA-N
XLogP3.09
TPSA101.55 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds9
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500487.58
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

N-(2,6-dimethoxyphenyl)-5-[5-[ethyl(dimethyl)silyl]-2-methylphenoxy]-3-oxofuran-2-carboxamide
CID 69368379
N-(2,6-dimethoxyphenyl)-5-[5-[2,2-dimethylpropyl(dimethyl)silyl]-2-methylphenoxy]-3-oxofuran-2-carboxamide
CID 69369586
3-oxo-N-(2,4,6-trimethoxyphenyl)-5-[(4,4,7-trimethyl-2,3-dihydro-1,4-benzoxasilin-6-yl)oxy]furan-2-carboxamide
CID 69401601
5-[(6-chloro-1,1-dimethyl-3,4-dihydro-2H-1-benzosilin-7-yl)oxy]-3-oxo-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide
CID 69401773
5-(2-methoxy-5-trimethylsilylphenoxy)-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide
CID 11236781
N-[2-[ethyl-[2-(propan-2-ylamino)ethyl]amino]-4,6-dimethoxypyrimidin-5-yl]-5-(2-methyl-5-trimethylsilylphenoxy)-3-oxofuran-2-carboxamide
CID 69131107
(2,4,6-trimethoxyphenyl)carbamothioic S-acid
CID 115169717
1-(2H-tetrazol-5-yl)-3-(2,4,6-trimethoxyphenyl)urea
CID 10851307
2-oxo-2-(2,4,6-trimethoxyanilino)acetic acid
CID 82499633
5-[2-methyl-4,5-bis(trimethylsilyl)phenoxy]-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide
CID 11329981
4-chloro-N-(2,4,6-trimethoxyphenyl)benzamide
CID 110778514
[2-[(2,4,6-trimethoxyphenyl)carbamoyl]hydrazinyl]phosphonic acid
CID 19764431

Frequently Asked Questions

What is the IUPAC name of 5-(2-methoxy-5-trimethylsilylphenoxy)-3-oxo-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide?
The IUPAC name of 5-(2-methoxy-5-trimethylsilylphenoxy)-3-oxo-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide (CID 69371762) is 5-(2-methoxy-5-trimethylsilylphenoxy)-3-oxo-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide.
What is the SMILES notation for 5-(2-methoxy-5-trimethylsilylphenoxy)-3-oxo-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide?
The canonical SMILES for 5-(2-methoxy-5-trimethylsilylphenoxy)-3-oxo-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide is COc1cc(OC)c(NC(=O)C2OC(Oc3cc([Si](C)(C)C)ccc3OC)=CC2=O)c(OC)c1.
What is the InChIKey of 5-(2-methoxy-5-trimethylsilylphenoxy)-3-oxo-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide?
The InChIKey is HMPWJWYJLPQABO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29NO8Si/c1-28-14-10-19(30-3)22(20(11-14)31-4)25-24(27)23-16(26)13-21(33-23)32-18-12-15(34(5,6)7)8-9-17(18)29-2/h8-13,23H,1-7H3,(H,25,27).
What are the key properties of 5-(2-methoxy-5-trimethylsilylphenoxy)-3-oxo-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide?
5-(2-methoxy-5-trimethylsilylphenoxy)-3-oxo-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide has a molecular weight of 487.58 g/mol, XLogP of 3.09, 9 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methoxy-5-trimethylsilylphenoxy)-3-oxo-N-(2,4,6-trimethoxyphenyl)furan-2-carboxamide is sourced from PubChem (CID 69371762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).