1-N-[3-[dimethoxy(methyl)silyl]propyl]butane-1,2,4-triamine

C10H27N3O2Si — CID 141486440

IUPAC1-N-[3-[dimethoxy(methyl)silyl]propyl]butane-1,2,4-triamine
SMILESCO[Si](C)(CCCNCC(N)CCN)OC
InChIInChI=1S/C10H27N3O2Si/c1-14-16(3,15-2)8-4-7-13-9-10(12)5-6-11/h10,13H,4-9,11-12H2,1-3H3
InChIKeyYNBIUGICGXOBEW-UHFFFAOYSA-N
MW249.43 g/mol
LogP0.01
Rot. Bonds10

About 1-N-[3-[dimethoxy(methyl)silyl]propyl]butane-1,2,4-triamine

1-N-[3-[dimethoxy(methyl)silyl]propyl]butane-1,2,4-triamine (PubChem CID 141486440) has the molecular formula C10H27N3O2Si and a molecular weight of 249.43 g/mol. Its IUPAC name is 1-N-[3-[dimethoxy(methyl)silyl]propyl]butane-1,2,4-triamine.

Molecular Properties

Compound Name1-N-[3-[dimethoxy(methyl)silyl]propyl]butane-1,2,4-triamine
PubChem CID141486440
Molecular FormulaC10H27N3O2Si
Molecular Weight249.43 g/mol
Exact Mass249.19
IUPAC Name1-N-[3-[dimethoxy(methyl)silyl]propyl]butane-1,2,4-triamine
SMILESCO[Si](C)(CCCNCC(N)CCN)OC
InChIInChI=1S/C10H27N3O2Si/c1-14-16(3,15-2)8-4-7-13-9-10(12)5-6-11/h10,13H,4-9,11-12H2,1-3H3
InChIKeyYNBIUGICGXOBEW-UHFFFAOYSA-N
XLogP0.01
TPSA82.53 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.43
LogP ≤ 50.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

(Trimethoxysilylpropyl)ethylenediamine
CID 15659
3-((Trimethoxysilyl)propyl)diethylenetriamine
CID 118771
N-(2-Aminoethyl)-3-aminopropylmethyldimethoxysilane
CID 76482
N-(3-(dimethoxymethylsilyl)-2-methylpropyl)ethylenediamine
CID 90922
3-((3-Aminopropyl)amino)propyl trimethoxysilane
CID 212847
1,2-Ethanediamine, N1-(3-(trimethoxysilyl)propyl)-, hydrochloride (1:1)
CID 116570
N-(3-(Methoxydimethylsilyl)propyl)ethylenediamine
CID 76484
N-{3-[Dimethoxy(methyl)silyl]propyl}butan-1-amine
CID 2762418
N-(3-(Diethoxymethylsilyl)propyl)ethylenediamine
CID 14177532
N~1~-[2-(Trimethoxysilyl)ethyl]propane-1,3-diamine
CID 18006729
N~1~-[1-(Trimethoxysilyl)propyl]ethane-1,2-diamine
CID 19086198
[3-[(4-Aminobutyl)amino]propyl]trimethoxysilane
CID 19350034

Frequently Asked Questions

What is the IUPAC name of 1-N-[3-[dimethoxy(methyl)silyl]propyl]butane-1,2,4-triamine?
The IUPAC name of 1-N-[3-[dimethoxy(methyl)silyl]propyl]butane-1,2,4-triamine (CID 141486440) is 1-N-[3-[dimethoxy(methyl)silyl]propyl]butane-1,2,4-triamine.
What is the SMILES notation for 1-N-[3-[dimethoxy(methyl)silyl]propyl]butane-1,2,4-triamine?
The canonical SMILES for 1-N-[3-[dimethoxy(methyl)silyl]propyl]butane-1,2,4-triamine is CO[Si](C)(CCCNCC(N)CCN)OC.
What is the InChIKey of 1-N-[3-[dimethoxy(methyl)silyl]propyl]butane-1,2,4-triamine?
The InChIKey is YNBIUGICGXOBEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H27N3O2Si/c1-14-16(3,15-2)8-4-7-13-9-10(12)5-6-11/h10,13H,4-9,11-12H2,1-3H3.
What are the key properties of 1-N-[3-[dimethoxy(methyl)silyl]propyl]butane-1,2,4-triamine?
1-N-[3-[dimethoxy(methyl)silyl]propyl]butane-1,2,4-triamine has a molecular weight of 249.43 g/mol, XLogP of 0.01, 10 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-[3-[dimethoxy(methyl)silyl]propyl]butane-1,2,4-triamine is sourced from PubChem (CID 141486440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).