2-[3-hydroxy-5-[2-tri(propan-2-yl)silyloxyethoxy]phenyl]acetamide

C19H33NO4Si — CID 18770868

IUPAC2-[3-hydroxy-5-[2-tri(propan-2-yl)silyloxyethoxy]phenyl]acetamide
SMILESCC(C)[Si](OCCOc1cc(O)cc(CC(N)=O)c1)(C(C)C)C(C)C
InChIInChI=1S/C19H33NO4Si/c1-13(2)25(14(3)4,15(5)6)24-8-7-23-18-10-16(11-19(20)22)9-17(21)12-18/h9-10,12-15,21H,7-8,11H2,1-6H3,(H2,20,22)
InChIKeyKQJCKLVEPAUTKP-UHFFFAOYSA-N
MW367.56 g/mol
LogP3.99
Rot. Bonds10

About 2-[3-hydroxy-5-[2-tri(propan-2-yl)silyloxyethoxy]phenyl]acetamide

2-[3-hydroxy-5-[2-tri(propan-2-yl)silyloxyethoxy]phenyl]acetamide (PubChem CID 18770868) has the molecular formula C19H33NO4Si and a molecular weight of 367.56 g/mol. Its IUPAC name is 2-[3-hydroxy-5-[2-tri(propan-2-yl)silyloxyethoxy]phenyl]acetamide.

Molecular Properties

Compound Name2-[3-hydroxy-5-[2-tri(propan-2-yl)silyloxyethoxy]phenyl]acetamide
PubChem CID18770868
Molecular FormulaC19H33NO4Si
Molecular Weight367.56 g/mol
Exact Mass367.22
IUPAC Name2-[3-hydroxy-5-[2-tri(propan-2-yl)silyloxyethoxy]phenyl]acetamide
SMILESCC(C)[Si](OCCOc1cc(O)cc(CC(N)=O)c1)(C(C)C)C(C)C
InChIInChI=1S/C19H33NO4Si/c1-13(2)25(14(3)4,15(5)6)24-8-7-23-18-10-16(11-19(20)22)9-17(21)12-18/h9-10,12-15,21H,7-8,11H2,1-6H3,(H2,20,22)
InChIKeyKQJCKLVEPAUTKP-UHFFFAOYSA-N
XLogP3.99
TPSA81.78 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.56
LogP ≤ 53.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[3-hydroxy-5-[2-tri(propan-2-yl)silyloxyethoxy]phenyl]acetamide?
The IUPAC name of 2-[3-hydroxy-5-[2-tri(propan-2-yl)silyloxyethoxy]phenyl]acetamide (CID 18770868) is 2-[3-hydroxy-5-[2-tri(propan-2-yl)silyloxyethoxy]phenyl]acetamide.
What is the SMILES notation for 2-[3-hydroxy-5-[2-tri(propan-2-yl)silyloxyethoxy]phenyl]acetamide?
The canonical SMILES for 2-[3-hydroxy-5-[2-tri(propan-2-yl)silyloxyethoxy]phenyl]acetamide is CC(C)[Si](OCCOc1cc(O)cc(CC(N)=O)c1)(C(C)C)C(C)C.
What is the InChIKey of 2-[3-hydroxy-5-[2-tri(propan-2-yl)silyloxyethoxy]phenyl]acetamide?
The InChIKey is KQJCKLVEPAUTKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H33NO4Si/c1-13(2)25(14(3)4,15(5)6)24-8-7-23-18-10-16(11-19(20)22)9-17(21)12-18/h9-10,12-15,21H,7-8,11H2,1-6H3,(H2,20,22).
What are the key properties of 2-[3-hydroxy-5-[2-tri(propan-2-yl)silyloxyethoxy]phenyl]acetamide?
2-[3-hydroxy-5-[2-tri(propan-2-yl)silyloxyethoxy]phenyl]acetamide has a molecular weight of 367.56 g/mol, XLogP of 3.99, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-hydroxy-5-[2-tri(propan-2-yl)silyloxyethoxy]phenyl]acetamide is sourced from PubChem (CID 18770868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).