tri(propan-2-yl)silyl 3-[3-[methoxy(dimethyl)silyl]propylamino]-2-methylpropanoate

C19H43NO3Si2 — CID 88852245

IUPACtri(propan-2-yl)silyl 3-[3-[methoxy(dimethyl)silyl]propylamino]-2-methylpropanoate
SMILESCO[Si](C)(C)CCCNCC(C)C(=O)O[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C19H43NO3Si2/c1-15(2)25(16(3)4,17(5)6)23-19(21)18(7)14-20-12-11-13-24(9,10)22-8/h15-18,20H,11-14H2,1-10H3
InChIKeyIOGUTPXZQDEKDD-UHFFFAOYSA-N
MW389.73 g/mol
LogP5.17
Rot. Bonds12

About tri(propan-2-yl)silyl 3-[3-[methoxy(dimethyl)silyl]propylamino]-2-methylpropanoate

tri(propan-2-yl)silyl 3-[3-[methoxy(dimethyl)silyl]propylamino]-2-methylpropanoate (PubChem CID 88852245) has the molecular formula C19H43NO3Si2 and a molecular weight of 389.73 g/mol. Its IUPAC name is tri(propan-2-yl)silyl 3-[3-[methoxy(dimethyl)silyl]propylamino]-2-methylpropanoate.

Molecular Properties

Compound Nametri(propan-2-yl)silyl 3-[3-[methoxy(dimethyl)silyl]propylamino]-2-methylpropanoate
PubChem CID88852245
Molecular FormulaC19H43NO3Si2
Molecular Weight389.73 g/mol
Exact Mass389.28
IUPAC Nametri(propan-2-yl)silyl 3-[3-[methoxy(dimethyl)silyl]propylamino]-2-methylpropanoate
SMILESCO[Si](C)(C)CCCNCC(C)C(=O)O[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C19H43NO3Si2/c1-15(2)25(16(3)4,17(5)6)23-19(21)18(7)14-20-12-11-13-24(9,10)22-8/h15-18,20H,11-14H2,1-10H3
InChIKeyIOGUTPXZQDEKDD-UHFFFAOYSA-N
XLogP5.17
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500389.73
LogP ≤ 55.17
H-Bond Donors ≤ 51
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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Related Compounds

tri(propan-2-yl)silyl 3-[3-[diethoxy(methyl)silyl]propylamino]-2-methylpropanoate
CID 88852346
2-methoxyethyl 3-[3-[dimethoxy(methyl)silyl]propylamino]-2-methylpropanoate
CID 59782863
tri(propan-2-yl)silyl 3-[3-[ethoxy(dimethyl)silyl]propylamino]propanoate
CID 88852274
triethylsilyl 2-methyl-3-(3-triethoxysilylpropylamino)propanoate
CID 88852142
2-[2-(2-propoxyethoxy)ethoxy]ethyl 2-methyl-3-(3-trimethoxysilylpropylamino)propanoate
CID 58122243
N'-[3-[methoxy(dimethyl)silyl]-2-methylpropyl]ethane-1,2-diamine
CID 53421710
methyl 2-methyl-3-(5-methylhexylamino)propanoate
CID 115325726
methyl 3-[(5-amino-5-oxopentyl)amino]-2-methylpropanoate
CID 106237219
trimethylsilyl 3-[3-[methoxy(dimethyl)silyl]propyl-methylamino]-2-methylpropanoate
CID 88852006
methyl (2R)-3-[3-(dimethylamino)propylamino]-2-methylpropanoate
CID 93035176
methyl 3-(2-hydroxyethylamino)-2-methylpropanoate
CID 43398406
methyl 3-[(5-hydroxy-4-methylpentyl)amino]-2-methylpropanoate
CID 106160216

Frequently Asked Questions

What is the IUPAC name of tri(propan-2-yl)silyl 3-[3-[methoxy(dimethyl)silyl]propylamino]-2-methylpropanoate?
The IUPAC name of tri(propan-2-yl)silyl 3-[3-[methoxy(dimethyl)silyl]propylamino]-2-methylpropanoate (CID 88852245) is tri(propan-2-yl)silyl 3-[3-[methoxy(dimethyl)silyl]propylamino]-2-methylpropanoate.
What is the SMILES notation for tri(propan-2-yl)silyl 3-[3-[methoxy(dimethyl)silyl]propylamino]-2-methylpropanoate?
The canonical SMILES for tri(propan-2-yl)silyl 3-[3-[methoxy(dimethyl)silyl]propylamino]-2-methylpropanoate is CO[Si](C)(C)CCCNCC(C)C(=O)O[Si](C(C)C)(C(C)C)C(C)C.
What is the InChIKey of tri(propan-2-yl)silyl 3-[3-[methoxy(dimethyl)silyl]propylamino]-2-methylpropanoate?
The InChIKey is IOGUTPXZQDEKDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H43NO3Si2/c1-15(2)25(16(3)4,17(5)6)23-19(21)18(7)14-20-12-11-13-24(9,10)22-8/h15-18,20H,11-14H2,1-10H3.
What are the key properties of tri(propan-2-yl)silyl 3-[3-[methoxy(dimethyl)silyl]propylamino]-2-methylpropanoate?
tri(propan-2-yl)silyl 3-[3-[methoxy(dimethyl)silyl]propylamino]-2-methylpropanoate has a molecular weight of 389.73 g/mol, XLogP of 5.17, 12 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tri(propan-2-yl)silyl 3-[3-[methoxy(dimethyl)silyl]propylamino]-2-methylpropanoate is sourced from PubChem (CID 88852245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).