N-[2-[tert-butyl(diphenyl)silyl]oxy-5-hydroxyphenyl]methanesulfonamide

C23H27NO4SSi — CID 101199405

IUPACN-[2-[tert-butyl(diphenyl)silyl]oxy-5-hydroxyphenyl]methanesulfonamide
SMILESCC(C)(C)[Si](Oc1ccc(O)cc1NS(C)(=O)=O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H27NO4SSi/c1-23(2,3)30(19-11-7-5-8-12-19,20-13-9-6-10-14-20)28-22-16-15-18(25)17-21(22)24-29(4,26)27/h5-17,24-25H,1-4H3
InChIKeyMDIZQKHHHJDRFK-UHFFFAOYSA-N
MW441.63 g/mol
LogP3.70
Rot. Bonds6

About N-[2-[tert-butyl(diphenyl)silyl]oxy-5-hydroxyphenyl]methanesulfonamide

N-[2-[tert-butyl(diphenyl)silyl]oxy-5-hydroxyphenyl]methanesulfonamide (PubChem CID 101199405) has the molecular formula C23H27NO4SSi and a molecular weight of 441.63 g/mol. Its IUPAC name is N-[2-[tert-butyl(diphenyl)silyl]oxy-5-hydroxyphenyl]methanesulfonamide.

Molecular Properties

Compound NameN-[2-[tert-butyl(diphenyl)silyl]oxy-5-hydroxyphenyl]methanesulfonamide
PubChem CID101199405
Molecular FormulaC23H27NO4SSi
Molecular Weight441.63 g/mol
Exact Mass441.14
IUPAC NameN-[2-[tert-butyl(diphenyl)silyl]oxy-5-hydroxyphenyl]methanesulfonamide
SMILESCC(C)(C)[Si](Oc1ccc(O)cc1NS(C)(=O)=O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H27NO4SSi/c1-23(2,3)30(19-11-7-5-8-12-19,20-13-9-6-10-14-20)28-22-16-15-18(25)17-21(22)24-29(4,26)27/h5-17,24-25H,1-4H3
InChIKeyMDIZQKHHHJDRFK-UHFFFAOYSA-N
XLogP3.70
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500441.63
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[4-bromo-2-[2-[tert-butyl(diphenyl)silyl]oxy-5-methylphenyl]naphthalen-1-yl]methanesulfonamide
CID 102599785
N-[[2-[tert-butyl(diphenyl)silyl]oxy-5-(methanesulfonamido)phenyl]methyl]-N-[(2-methylpropan-2-yl)oxy]formamide
CID 87742539
methyl 2-[3-[tert-butyl(diphenyl)silyl]oxy-5-hydroxyphenyl]acetate
CID 57443556
5-hydroxy-2-(methanesulfonamido)benzoic acid
CID 61406346
(3-bromonaphthalen-2-yl)oxy-tert-butyl-diphenylsilane
CID 101484237
methyl 5-[tert-butyl(diphenyl)silyl]oxy-3-hydroxynaphthalene-2-carboxylate
CID 123544517
2,4-bis[[tert-butyl(diphenyl)silyl]oxy]benzaldehyde
CID 44598255
N-[2,5-bis(phenylmethoxy)phenyl]methanesulfonamide
CID 70516197
tert-butyl-(2-nitrophenoxy)-diphenylsilane
CID 91423635
[3,5-bis[[tert-butyl(diphenyl)silyl]oxy]-2-(2-oxoethyl)phenyl] trifluoromethanesulfonate
CID 135010974
4-(methanesulfonamido)-3-phenylmethoxybenzoic acid
CID 166479657
N-(5-methoxy-2-phenoxyphenyl)methanesulfonamide
CID 10803650

Frequently Asked Questions

What is the IUPAC name of N-[2-[tert-butyl(diphenyl)silyl]oxy-5-hydroxyphenyl]methanesulfonamide?
The IUPAC name of N-[2-[tert-butyl(diphenyl)silyl]oxy-5-hydroxyphenyl]methanesulfonamide (CID 101199405) is N-[2-[tert-butyl(diphenyl)silyl]oxy-5-hydroxyphenyl]methanesulfonamide.
What is the SMILES notation for N-[2-[tert-butyl(diphenyl)silyl]oxy-5-hydroxyphenyl]methanesulfonamide?
The canonical SMILES for N-[2-[tert-butyl(diphenyl)silyl]oxy-5-hydroxyphenyl]methanesulfonamide is CC(C)(C)[Si](Oc1ccc(O)cc1NS(C)(=O)=O)(c1ccccc1)c1ccccc1.
What is the InChIKey of N-[2-[tert-butyl(diphenyl)silyl]oxy-5-hydroxyphenyl]methanesulfonamide?
The InChIKey is MDIZQKHHHJDRFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27NO4SSi/c1-23(2,3)30(19-11-7-5-8-12-19,20-13-9-6-10-14-20)28-22-16-15-18(25)17-21(22)24-29(4,26)27/h5-17,24-25H,1-4H3.
What are the key properties of N-[2-[tert-butyl(diphenyl)silyl]oxy-5-hydroxyphenyl]methanesulfonamide?
N-[2-[tert-butyl(diphenyl)silyl]oxy-5-hydroxyphenyl]methanesulfonamide has a molecular weight of 441.63 g/mol, XLogP of 3.70, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[tert-butyl(diphenyl)silyl]oxy-5-hydroxyphenyl]methanesulfonamide is sourced from PubChem (CID 101199405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).