N-[2-amino-5-[tert-butyl(diphenyl)silyl]oxy-4-methoxyphenyl]formamide

C24H28N2O3Si — CID 58622914

IUPACN-[2-amino-5-[tert-butyl(diphenyl)silyl]oxy-4-methoxyphenyl]formamide
SMILESCOc1cc(N)c(NC=O)cc1O[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C24H28N2O3Si/c1-24(2,3)30(18-11-7-5-8-12-18,19-13-9-6-10-14-19)29-23-16-21(26-17-27)20(25)15-22(23)28-4/h5-17H,25H2,1-4H3,(H,26,27)
InChIKeyRIDFAZQWPQHBGB-UHFFFAOYSA-N
MW420.59 g/mol
LogP3.78
Rot. Bonds7

About N-[2-amino-5-[tert-butyl(diphenyl)silyl]oxy-4-methoxyphenyl]formamide

N-[2-amino-5-[tert-butyl(diphenyl)silyl]oxy-4-methoxyphenyl]formamide (PubChem CID 58622914) has the molecular formula C24H28N2O3Si and a molecular weight of 420.59 g/mol. Its IUPAC name is N-[2-amino-5-[tert-butyl(diphenyl)silyl]oxy-4-methoxyphenyl]formamide.

Molecular Properties

Compound NameN-[2-amino-5-[tert-butyl(diphenyl)silyl]oxy-4-methoxyphenyl]formamide
PubChem CID58622914
Molecular FormulaC24H28N2O3Si
Molecular Weight420.59 g/mol
Exact Mass420.19
IUPAC NameN-[2-amino-5-[tert-butyl(diphenyl)silyl]oxy-4-methoxyphenyl]formamide
SMILESCOc1cc(N)c(NC=O)cc1O[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C24H28N2O3Si/c1-24(2,3)30(18-11-7-5-8-12-18,19-13-9-6-10-14-19)29-23-16-21(26-17-27)20(25)15-22(23)28-4/h5-17H,25H2,1-4H3,(H,26,27)
InChIKeyRIDFAZQWPQHBGB-UHFFFAOYSA-N
XLogP3.78
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.59
LogP ≤ 53.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[2-amino-5-[tert-butyl(diphenyl)silyl]oxy-4-methoxyphenyl]formamide?
The IUPAC name of N-[2-amino-5-[tert-butyl(diphenyl)silyl]oxy-4-methoxyphenyl]formamide (CID 58622914) is N-[2-amino-5-[tert-butyl(diphenyl)silyl]oxy-4-methoxyphenyl]formamide.
What is the SMILES notation for N-[2-amino-5-[tert-butyl(diphenyl)silyl]oxy-4-methoxyphenyl]formamide?
The canonical SMILES for N-[2-amino-5-[tert-butyl(diphenyl)silyl]oxy-4-methoxyphenyl]formamide is COc1cc(N)c(NC=O)cc1O[Si](c1ccccc1)(c1ccccc1)C(C)(C)C.
What is the InChIKey of N-[2-amino-5-[tert-butyl(diphenyl)silyl]oxy-4-methoxyphenyl]formamide?
The InChIKey is RIDFAZQWPQHBGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N2O3Si/c1-24(2,3)30(18-11-7-5-8-12-18,19-13-9-6-10-14-19)29-23-16-21(26-17-27)20(25)15-22(23)28-4/h5-17H,25H2,1-4H3,(H,26,27).
What are the key properties of N-[2-amino-5-[tert-butyl(diphenyl)silyl]oxy-4-methoxyphenyl]formamide?
N-[2-amino-5-[tert-butyl(diphenyl)silyl]oxy-4-methoxyphenyl]formamide has a molecular weight of 420.59 g/mol, XLogP of 3.78, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-amino-5-[tert-butyl(diphenyl)silyl]oxy-4-methoxyphenyl]formamide is sourced from PubChem (CID 58622914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).