4-[aminomethoxy(dimethoxy)silyl]-3-methylbutan-1-amine

C8H22N2O3Si — CID 172796806

IUPAC4-[aminomethoxy(dimethoxy)silyl]-3-methylbutan-1-amine
SMILESCO[Si](CC(C)CCN)(OC)OCN
InChIInChI=1S/C8H22N2O3Si/c1-8(4-5-9)6-14(11-2,12-3)13-7-10/h8H,4-7,9-10H2,1-3H3
InChIKeyQHUZPMBREIJBFL-UHFFFAOYSA-N
MW222.36 g/mol
LogP0.14
Rot. Bonds8

About 4-[aminomethoxy(dimethoxy)silyl]-3-methylbutan-1-amine

4-[aminomethoxy(dimethoxy)silyl]-3-methylbutan-1-amine (PubChem CID 172796806) has the molecular formula C8H22N2O3Si and a molecular weight of 222.36 g/mol. Its IUPAC name is 4-[aminomethoxy(dimethoxy)silyl]-3-methylbutan-1-amine.

Molecular Properties

Compound Name4-[aminomethoxy(dimethoxy)silyl]-3-methylbutan-1-amine
PubChem CID172796806
Molecular FormulaC8H22N2O3Si
Molecular Weight222.36 g/mol
Exact Mass222.14
IUPAC Name4-[aminomethoxy(dimethoxy)silyl]-3-methylbutan-1-amine
SMILESCO[Si](CC(C)CCN)(OC)OCN
InChIInChI=1S/C8H22N2O3Si/c1-8(4-5-9)6-14(11-2,12-3)13-7-10/h8H,4-7,9-10H2,1-3H3
InChIKeyQHUZPMBREIJBFL-UHFFFAOYSA-N
XLogP0.14
TPSA79.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.36
LogP ≤ 50.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

4-(aminomethoxy-methoxy-methylsilyl)-3-methylbutan-1-amine
CID 151721638
3-(2-methyl-3-trimethoxysilylpropoxy)butan-1-amine
CID 154190244
[ethyl(dimethoxy)silyl]oxymethanamine
CID 88738935
3-methyl-4-trimethoxysilylbutane-1-thiol
CID 140918157
3-methyl-6-trimethoxysilylhexane-1,4-diamine
CID 175289204
5-[dimethoxy(methyl)silyl]-4-methylpentan-1-amine
CID 90000038
[dimethoxy(propan-2-yl)silyl]oxymethanamine
CID 154110052
(2S)-2-methylbutane-1,4-diamine
CID 51382069
3-[ethoxy(dimethoxy)silyl]-N-ethyl-2-methylpropan-1-amine
CID 87148953
N'-(1-trimethoxysilylpropan-2-yl)ethane-1,2-diamine
CID 22661604
trimethoxy(4-methylheptyl)silane
CID 23534240
3-[methoxy-di(propan-2-yloxy)silyl]propan-1-amine
CID 140917139

Frequently Asked Questions

What is the IUPAC name of 4-[aminomethoxy(dimethoxy)silyl]-3-methylbutan-1-amine?
The IUPAC name of 4-[aminomethoxy(dimethoxy)silyl]-3-methylbutan-1-amine (CID 172796806) is 4-[aminomethoxy(dimethoxy)silyl]-3-methylbutan-1-amine.
What is the SMILES notation for 4-[aminomethoxy(dimethoxy)silyl]-3-methylbutan-1-amine?
The canonical SMILES for 4-[aminomethoxy(dimethoxy)silyl]-3-methylbutan-1-amine is CO[Si](CC(C)CCN)(OC)OCN.
What is the InChIKey of 4-[aminomethoxy(dimethoxy)silyl]-3-methylbutan-1-amine?
The InChIKey is QHUZPMBREIJBFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H22N2O3Si/c1-8(4-5-9)6-14(11-2,12-3)13-7-10/h8H,4-7,9-10H2,1-3H3.
What are the key properties of 4-[aminomethoxy(dimethoxy)silyl]-3-methylbutan-1-amine?
4-[aminomethoxy(dimethoxy)silyl]-3-methylbutan-1-amine has a molecular weight of 222.36 g/mol, XLogP of 0.14, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[aminomethoxy(dimethoxy)silyl]-3-methylbutan-1-amine is sourced from PubChem (CID 172796806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).