N-[[butan-2-yl(dimethoxy)silyl]oxymethyl]ethanamine

C9H23NO3Si — CID 175160121

IUPACN-[[butan-2-yl(dimethoxy)silyl]oxymethyl]ethanamine
SMILESCCNCO[Si](OC)(OC)C(C)CC
InChIInChI=1S/C9H23NO3Si/c1-6-9(3)14(11-4,12-5)13-8-10-7-2/h9-10H,6-8H2,1-5H3
InChIKeyLLNAPJMNGFFEKP-UHFFFAOYSA-N
MW221.37 g/mol
LogP1.60
Rot. Bonds8

About N-[[butan-2-yl(dimethoxy)silyl]oxymethyl]ethanamine

N-[[butan-2-yl(dimethoxy)silyl]oxymethyl]ethanamine (PubChem CID 175160121) has the molecular formula C9H23NO3Si and a molecular weight of 221.37 g/mol. Its IUPAC name is N-[[butan-2-yl(dimethoxy)silyl]oxymethyl]ethanamine.

Molecular Properties

Compound NameN-[[butan-2-yl(dimethoxy)silyl]oxymethyl]ethanamine
PubChem CID175160121
Molecular FormulaC9H23NO3Si
Molecular Weight221.37 g/mol
Exact Mass221.14
IUPAC NameN-[[butan-2-yl(dimethoxy)silyl]oxymethyl]ethanamine
SMILESCCNCO[Si](OC)(OC)C(C)CC
InChIInChI=1S/C9H23NO3Si/c1-6-9(3)14(11-4,12-5)13-8-10-7-2/h9-10H,6-8H2,1-5H3
InChIKeyLLNAPJMNGFFEKP-UHFFFAOYSA-N
XLogP1.60
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.37
LogP ≤ 51.60
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'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

N-[[dimethoxy(propan-2-yl)silyl]oxymethyl]ethanamine
CID 140676529
di(butan-2-yl)-dimethoxysilane
CID 11687104
N-(propan-2-yloxymethyl)ethanamine
CID 58821109
(1S)-N-ethyl-2-methyl-1-trimethoxysilylpropan-1-amine
CID 99865004
N-[bis(trimethoxysilyl)methyl]ethanamine
CID 174997773
bromo-butan-2-yl-dimethoxysilane
CID 175042063
N-methyl-1-trimethoxysilylpropan-1-amine
CID 19607493
1-N'-(1-trimethoxysilylethyl)propane-1,1-diamine
CID 22341658
3-[ethoxy(dimethoxy)silyl]-N-ethyl-2-methylpropan-1-amine
CID 87148953
3-[diethoxy(methoxy)silyl]-N-ethyl-2-methylpropan-1-amine
CID 87149314
N,N-di(propan-2-yl)-1-trimethoxysilylpropan-1-amine
CID 87407225
butan-2-yl-dimethoxy-propylsilane
CID 22616756

Frequently Asked Questions

What is the IUPAC name of N-[[butan-2-yl(dimethoxy)silyl]oxymethyl]ethanamine?
The IUPAC name of N-[[butan-2-yl(dimethoxy)silyl]oxymethyl]ethanamine (CID 175160121) is N-[[butan-2-yl(dimethoxy)silyl]oxymethyl]ethanamine.
What is the SMILES notation for N-[[butan-2-yl(dimethoxy)silyl]oxymethyl]ethanamine?
The canonical SMILES for N-[[butan-2-yl(dimethoxy)silyl]oxymethyl]ethanamine is CCNCO[Si](OC)(OC)C(C)CC.
What is the InChIKey of N-[[butan-2-yl(dimethoxy)silyl]oxymethyl]ethanamine?
The InChIKey is LLNAPJMNGFFEKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H23NO3Si/c1-6-9(3)14(11-4,12-5)13-8-10-7-2/h9-10H,6-8H2,1-5H3.
What are the key properties of N-[[butan-2-yl(dimethoxy)silyl]oxymethyl]ethanamine?
N-[[butan-2-yl(dimethoxy)silyl]oxymethyl]ethanamine has a molecular weight of 221.37 g/mol, XLogP of 1.60, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[butan-2-yl(dimethoxy)silyl]oxymethyl]ethanamine is sourced from PubChem (CID 175160121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).