CID 162470335

C17H36NO5Si4 — CID 162470335

IUPAC—
SMILESC=C(C)C(=O)OCCC[Si](O[Si](C)CCC#N)(O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C17H36NO5Si4/c1-16(2)17(19)20-13-11-15-27(22-25(4,5)6,23-26(7,8)9)21-24(3)14-10-12-18/h1,10-11,13-15H2,2-9H3
InChIKeyIIRKNZMJONKDEO-UHFFFAOYSA-N
MW446.82 g/mol
LogP4.69
Rot. Bonds13

About CID 162470335

CID 162470335 (PubChem CID 162470335) has the molecular formula C17H36NO5Si4 and a molecular weight of 446.82 g/mol.

Molecular Properties

Compound NameCID 162470335
PubChem CID162470335
Molecular FormulaC17H36NO5Si4
Molecular Weight446.82 g/mol
Exact Mass446.17
IUPAC Name—
SMILESC=C(C)C(=O)OCCC[Si](O[Si](C)CCC#N)(O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C17H36NO5Si4/c1-16(2)17(19)20-13-11-15-27(22-25(4,5)6,23-26(7,8)9)21-24(3)14-10-12-18/h1,10-11,13-15H2,2-9H3
InChIKeyIIRKNZMJONKDEO-UHFFFAOYSA-N
XLogP4.69
TPSA77.78 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds13
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500446.82
LogP ≤ 54.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

tris(2-methylprop-2-enamide);3-tris(trimethylsilyloxy)silylpropyl 2-methylprop-2-enoate
CID 158000142
3-tris[[dimethyl-[2-tris(trimethylsilyloxy)silylethyl]silyl]oxy]silylpropyl 2-methylprop-2-enoate
CID 88568225
3-tris[tris(trimethylsilyloxy)silyloxy]silylpropyl 2-methylprop-2-enoate
CID 54059170
azane;3-trimethoxysilylpropyl 2-methylprop-2-enoate
CID 174919252
3-[[[[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propyl 2-methylprop-2-enoate
CID 101031805
3-[[[bis[[dimethyl-[3-(2-methylprop-2-enoyloxy)propyl]silyl]oxy-dimethylsilyl]-trimethylsilyloxysilyl]-dimethylsilyl]oxy-dimethylsilyl]propyl 2-methylprop-2-enoate
CID 21242018
3-[dipropyl(trimethylsilyloxy)silyl]propyl 2-methylprop-2-enoate
CID 18739228
3-[bis[[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]oxy]-methylsilyl]propyl 2-methylprop-2-enoate
CID 18739209
CID 137081739
CID 137081739
3-[hydroxy(dimethyl)silyl]propyl 2-methylprop-2-enoate
CID 11009006
3-[[bis[methyl-[3-(2-methylprop-2-enoyloxy)propyl]-trimethylsilyloxysilyl]-silylmethyl]-methyl-trimethylsilyloxysilyl]propyl 2-methylprop-2-enoate
CID 149435617
3-[dimethyl(propyl)silyl]propyl 2-methylprop-2-enoate
CID 139977940

Frequently Asked Questions

What is the IUPAC name of CID 162470335?
The IUPAC name of CID 162470335 (CID 162470335) is not available.
What is the SMILES notation for CID 162470335?
The canonical SMILES for CID 162470335 is C=C(C)C(=O)OCCC[Si](O[Si](C)CCC#N)(O[Si](C)(C)C)O[Si](C)(C)C.
What is the InChIKey of CID 162470335?
The InChIKey is IIRKNZMJONKDEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H36NO5Si4/c1-16(2)17(19)20-13-11-15-27(22-25(4,5)6,23-26(7,8)9)21-24(3)14-10-12-18/h1,10-11,13-15H2,2-9H3.
What are the key properties of CID 162470335?
CID 162470335 has a molecular weight of 446.82 g/mol, XLogP of 4.69, 13 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for CID 162470335 is sourced from PubChem (CID 162470335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).