3-methyl-6-trimethoxysilylhexane-1,4-diamine

C10H26N2O3Si — CID 175289204

IUPAC3-methyl-6-trimethoxysilylhexane-1,4-diamine
SMILESCO[Si](CCC(N)C(C)CCN)(OC)OC
InChIInChI=1S/C10H26N2O3Si/c1-9(5-7-11)10(12)6-8-16(13-2,14-3)15-4/h9-10H,5-8,11-12H2,1-4H3
InChIKeyZQKLWXHIWPPWEL-UHFFFAOYSA-N
MW250.41 g/mol
LogP0.57
Rot. Bonds9

About 3-methyl-6-trimethoxysilylhexane-1,4-diamine

3-methyl-6-trimethoxysilylhexane-1,4-diamine (PubChem CID 175289204) has the molecular formula C10H26N2O3Si and a molecular weight of 250.41 g/mol. Its IUPAC name is 3-methyl-6-trimethoxysilylhexane-1,4-diamine.

Molecular Properties

Compound Name3-methyl-6-trimethoxysilylhexane-1,4-diamine
PubChem CID175289204
Molecular FormulaC10H26N2O3Si
Molecular Weight250.41 g/mol
Exact Mass250.17
IUPAC Name3-methyl-6-trimethoxysilylhexane-1,4-diamine
SMILESCO[Si](CCC(N)C(C)CCN)(OC)OC
InChIInChI=1S/C10H26N2O3Si/c1-9(5-7-11)10(12)6-8-16(13-2,14-3)15-4/h9-10H,5-8,11-12H2,1-4H3
InChIKeyZQKLWXHIWPPWEL-UHFFFAOYSA-N
XLogP0.57
TPSA79.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.41
LogP ≤ 50.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

1,5-bis(trimethoxysilyl)pentan-3-amine
CID 87668176
1,8-bis(trimethoxysilyl)octane-4,5-diamine
CID 57029504
1-[dimethoxy(propyl)silyl]oxypropane-1,3-diamine
CID 87996086
5-[methoxy(dimethyl)silyl]pentane-1,3-diamine
CID 87772527
4-trimethoxysilylbutan-2-ol
CID 19880936
1-N-methyl-5-trimethoxysilylpentane-1,3-diamine
CID 156883360
4-[aminomethoxy(dimethoxy)silyl]-3-methylbutan-1-amine
CID 172796806
3-trimethoxysilylpentane-1,4-diamine
CID 18387104
hexane;3-trimethoxysilylpropane-1,1-diamine
CID 174757276
3-[methoxy-di(propan-2-yloxy)silyl]propan-1-amine
CID 140917139
2-(2-trimethoxysilylethoxy)propan-1-amine
CID 59561245
(4R)-3-trimethoxysilylpentane-1,4-diamine
CID 174577695

Frequently Asked Questions

What is the IUPAC name of 3-methyl-6-trimethoxysilylhexane-1,4-diamine?
The IUPAC name of 3-methyl-6-trimethoxysilylhexane-1,4-diamine (CID 175289204) is 3-methyl-6-trimethoxysilylhexane-1,4-diamine.
What is the SMILES notation for 3-methyl-6-trimethoxysilylhexane-1,4-diamine?
The canonical SMILES for 3-methyl-6-trimethoxysilylhexane-1,4-diamine is CO[Si](CCC(N)C(C)CCN)(OC)OC.
What is the InChIKey of 3-methyl-6-trimethoxysilylhexane-1,4-diamine?
The InChIKey is ZQKLWXHIWPPWEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H26N2O3Si/c1-9(5-7-11)10(12)6-8-16(13-2,14-3)15-4/h9-10H,5-8,11-12H2,1-4H3.
What are the key properties of 3-methyl-6-trimethoxysilylhexane-1,4-diamine?
3-methyl-6-trimethoxysilylhexane-1,4-diamine has a molecular weight of 250.41 g/mol, XLogP of 0.57, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-6-trimethoxysilylhexane-1,4-diamine is sourced from PubChem (CID 175289204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).