1-N-methyl-5-trimethoxysilylpentane-1,3-diamine

C9H24N2O3Si — CID 156883360

IUPAC1-N-methyl-5-trimethoxysilylpentane-1,3-diamine
SMILESCNCCC(N)CC[Si](OC)(OC)OC
InChIInChI=1S/C9H24N2O3Si/c1-11-7-5-9(10)6-8-15(12-2,13-3)14-4/h9,11H,5-8,10H2,1-4H3
InChIKeyUXIPBESTVCAEDZ-UHFFFAOYSA-N
MW236.39 g/mol
LogP0.19
Rot. Bonds9

About 1-N-methyl-5-trimethoxysilylpentane-1,3-diamine

1-N-methyl-5-trimethoxysilylpentane-1,3-diamine (PubChem CID 156883360) has the molecular formula C9H24N2O3Si and a molecular weight of 236.39 g/mol. Its IUPAC name is 1-N-methyl-5-trimethoxysilylpentane-1,3-diamine.

Molecular Properties

Compound Name1-N-methyl-5-trimethoxysilylpentane-1,3-diamine
PubChem CID156883360
Molecular FormulaC9H24N2O3Si
Molecular Weight236.39 g/mol
Exact Mass236.16
IUPAC Name1-N-methyl-5-trimethoxysilylpentane-1,3-diamine
SMILESCNCCC(N)CC[Si](OC)(OC)OC
InChIInChI=1S/C9H24N2O3Si/c1-11-7-5-9(10)6-8-15(12-2,13-3)14-4/h9,11H,5-8,10H2,1-4H3
InChIKeyUXIPBESTVCAEDZ-UHFFFAOYSA-N
XLogP0.19
TPSA65.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.39
LogP ≤ 50.19
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
1,5-bis(trimethoxysilyl)pentan-3-ol
CID 142667270
3-methyl-6-trimethoxysilylhexane-1,4-diamine
CID 175289204
5-[dimethoxy(methyl)silyl]-1-N-ethoxypentane-1,3-diamine
CID 150228129
hexane;3-trimethoxysilylpropane-1,1-diamine
CID 174757276
N-methyl-N'-[2-[2-(3-trimethoxysilylpropylamino)ethylamino]ethyl]ethane-1,2-diamine
CID 134961256
1,8-bis(trimethoxysilyl)octane-4,5-diamine
CID 57029504
2-(methylamino)ethanol;trimethoxy(propyl)silane
CID 175346273
5-[methoxy(dimethyl)silyl]pentane-1,3-diamine
CID 87772527
3-[dimethoxy-[3-(methylamino)propoxy]silyl]propan-1-amine
CID 87114848
2-N-(2-aminoethyl)-5-trimethoxysilylpentane-1,2-diamine
CID 87271772
4-trimethoxysilylbutan-2-ol
CID 19880936

Frequently Asked Questions

What is the IUPAC name of 1-N-methyl-5-trimethoxysilylpentane-1,3-diamine?
The IUPAC name of 1-N-methyl-5-trimethoxysilylpentane-1,3-diamine (CID 156883360) is 1-N-methyl-5-trimethoxysilylpentane-1,3-diamine.
What is the SMILES notation for 1-N-methyl-5-trimethoxysilylpentane-1,3-diamine?
The canonical SMILES for 1-N-methyl-5-trimethoxysilylpentane-1,3-diamine is CNCCC(N)CC[Si](OC)(OC)OC.
What is the InChIKey of 1-N-methyl-5-trimethoxysilylpentane-1,3-diamine?
The InChIKey is UXIPBESTVCAEDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H24N2O3Si/c1-11-7-5-9(10)6-8-15(12-2,13-3)14-4/h9,11H,5-8,10H2,1-4H3.
What are the key properties of 1-N-methyl-5-trimethoxysilylpentane-1,3-diamine?
1-N-methyl-5-trimethoxysilylpentane-1,3-diamine has a molecular weight of 236.39 g/mol, XLogP of 0.19, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-methyl-5-trimethoxysilylpentane-1,3-diamine is sourced from PubChem (CID 156883360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).