1-(dimethoxymethylsilyl)-3,3-dimethylbutan-1-amine

C9H23NO2Si — CID 174672141

IUPAC1-(dimethoxymethylsilyl)-3,3-dimethylbutan-1-amine
SMILESCOC(OC)[SiH2]C(N)CC(C)(C)C
InChIInChI=1S/C9H23NO2Si/c1-9(2,3)6-7(10)13-8(11-4)12-5/h7-8H,6,10,13H2,1-5H3
InChIKeyQKTXIVHCPZNJNE-UHFFFAOYSA-N
MW205.37 g/mol
LogP0.45
Rot. Bonds5

About 1-(dimethoxymethylsilyl)-3,3-dimethylbutan-1-amine

1-(dimethoxymethylsilyl)-3,3-dimethylbutan-1-amine (PubChem CID 174672141) has the molecular formula C9H23NO2Si and a molecular weight of 205.37 g/mol. Its IUPAC name is 1-(dimethoxymethylsilyl)-3,3-dimethylbutan-1-amine.

Molecular Properties

Compound Name1-(dimethoxymethylsilyl)-3,3-dimethylbutan-1-amine
PubChem CID174672141
Molecular FormulaC9H23NO2Si
Molecular Weight205.37 g/mol
Exact Mass205.15
IUPAC Name1-(dimethoxymethylsilyl)-3,3-dimethylbutan-1-amine
SMILESCOC(OC)[SiH2]C(N)CC(C)(C)C
InChIInChI=1S/C9H23NO2Si/c1-9(2,3)6-7(10)13-8(11-4)12-5/h7-8H,6,10,13H2,1-5H3
InChIKeyQKTXIVHCPZNJNE-UHFFFAOYSA-N
XLogP0.45
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.37
LogP ≤ 50.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

3-methoxy-2,2,5,5-tetramethylhexane
CID 12756025
methyl (2R)-2-hydroxy-4,4-dimethylpentanoate
CID 59424547
dichloromethyl(dimethoxymethyl)silane
CID 123486907
(2R)-4,4-dimethylpentan-2-amine;hydrochloride
CID 164901043
methyl 2-(hydroxymethyl)-4,4-dimethylpentanoate
CID 86048899
1,2-dimethoxy-4,4-dimethylpentane
CID 59679444
1,1,1-trifluoro-2-methoxy-4,4-dimethylpentane
CID 170375646
1-methoxy-6,6-dimethylheptan-4-amine
CID 115619597
tris[2-(dimethoxymethylsilyl)propyl]silane
CID 123172029
2-methoxy-4,4-dimethylpentanal
CID 58639918
dimethoxymethylsilylmethyl 2,2-dimethylpropanoate
CID 150643555
1,1,1-trifluoro-4,4-dimethylpentan-2-amine
CID 63898477

Frequently Asked Questions

What is the IUPAC name of 1-(dimethoxymethylsilyl)-3,3-dimethylbutan-1-amine?
The IUPAC name of 1-(dimethoxymethylsilyl)-3,3-dimethylbutan-1-amine (CID 174672141) is 1-(dimethoxymethylsilyl)-3,3-dimethylbutan-1-amine.
What is the SMILES notation for 1-(dimethoxymethylsilyl)-3,3-dimethylbutan-1-amine?
The canonical SMILES for 1-(dimethoxymethylsilyl)-3,3-dimethylbutan-1-amine is COC(OC)[SiH2]C(N)CC(C)(C)C.
What is the InChIKey of 1-(dimethoxymethylsilyl)-3,3-dimethylbutan-1-amine?
The InChIKey is QKTXIVHCPZNJNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H23NO2Si/c1-9(2,3)6-7(10)13-8(11-4)12-5/h7-8H,6,10,13H2,1-5H3.
What are the key properties of 1-(dimethoxymethylsilyl)-3,3-dimethylbutan-1-amine?
1-(dimethoxymethylsilyl)-3,3-dimethylbutan-1-amine has a molecular weight of 205.37 g/mol, XLogP of 0.45, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(dimethoxymethylsilyl)-3,3-dimethylbutan-1-amine is sourced from PubChem (CID 174672141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).