3-[dimethoxy-[3-(methylamino)propoxy]silyl]propan-1-amine

C9H24N2O3Si — CID 87114848

IUPAC3-[dimethoxy-[3-(methylamino)propoxy]silyl]propan-1-amine
SMILESCNCCCO[Si](CCCN)(OC)OC
InChIInChI=1S/C9H24N2O3Si/c1-11-7-5-8-14-15(12-2,13-3)9-4-6-10/h11H,4-10H2,1-3H3
InChIKeyZIWFZQHJYBOJGR-UHFFFAOYSA-N
MW236.39 g/mol
LogP0.19
Rot. Bonds10

About 3-[dimethoxy-[3-(methylamino)propoxy]silyl]propan-1-amine

3-[dimethoxy-[3-(methylamino)propoxy]silyl]propan-1-amine (PubChem CID 87114848) has the molecular formula C9H24N2O3Si and a molecular weight of 236.39 g/mol. Its IUPAC name is 3-[dimethoxy-[3-(methylamino)propoxy]silyl]propan-1-amine.

Molecular Properties

Compound Name3-[dimethoxy-[3-(methylamino)propoxy]silyl]propan-1-amine
PubChem CID87114848
Molecular FormulaC9H24N2O3Si
Molecular Weight236.39 g/mol
Exact Mass236.16
IUPAC Name3-[dimethoxy-[3-(methylamino)propoxy]silyl]propan-1-amine
SMILESCNCCCO[Si](CCCN)(OC)OC
InChIInChI=1S/C9H24N2O3Si/c1-11-7-5-8-14-15(12-2,13-3)9-4-6-10/h11H,4-10H2,1-3H3
InChIKeyZIWFZQHJYBOJGR-UHFFFAOYSA-N
XLogP0.19
TPSA65.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
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': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

N-methyl-3-trimethoxysilylpropan-1-amine;3-[tris(2-methoxyethoxy)silyl]propan-1-amine
CID 157071807
N'-[3-[dimethoxy(propyl)silyl]oxypropyl]ethane-1,2-diamine
CID 141429478
N'-(2-aminoethyl)ethane-1,2-diamine;3-trimethoxysilylpropan-1-amine
CID 158654505
N-methyl-3-tributoxysilylpropan-1-amine
CID 87391631
3-[dimethoxy(undecyl)silyl]oxypropan-1-amine
CID 156751574
butoxy-butyl-dimethoxysilane
CID 139714527
bis(oxygen(2-));titanium(4+);3-trimethoxysilylpropan-1-amine
CID 161482517
3-[diethoxy(methoxy)silyl]propan-1-amine;3-[ethoxy(dimethoxy)silyl]propan-1-amine;3-trimethoxysilylpropan-1-amine
CID 159243688
acetic acid;N'-(2-aminoethyl)ethane-1,2-diamine;4-[3-aminopropyl(dimethoxy)silyl]oxybutan-1-amine;gadolinium(3+);triacetate
CID 173127362
cyclobutane;3-trimethoxysilylpropan-1-amine
CID 175187694
ethane;methanol;bis(3-trimethoxysilylpropan-1-amine)
CID 158708863
methanol;3-trimethoxysilylpropan-1-amine;hydrochloride
CID 174963553

Frequently Asked Questions

What is the IUPAC name of 3-[dimethoxy-[3-(methylamino)propoxy]silyl]propan-1-amine?
The IUPAC name of 3-[dimethoxy-[3-(methylamino)propoxy]silyl]propan-1-amine (CID 87114848) is 3-[dimethoxy-[3-(methylamino)propoxy]silyl]propan-1-amine.
What is the SMILES notation for 3-[dimethoxy-[3-(methylamino)propoxy]silyl]propan-1-amine?
The canonical SMILES for 3-[dimethoxy-[3-(methylamino)propoxy]silyl]propan-1-amine is CNCCCO[Si](CCCN)(OC)OC.
What is the InChIKey of 3-[dimethoxy-[3-(methylamino)propoxy]silyl]propan-1-amine?
The InChIKey is ZIWFZQHJYBOJGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H24N2O3Si/c1-11-7-5-8-14-15(12-2,13-3)9-4-6-10/h11H,4-10H2,1-3H3.
What are the key properties of 3-[dimethoxy-[3-(methylamino)propoxy]silyl]propan-1-amine?
3-[dimethoxy-[3-(methylamino)propoxy]silyl]propan-1-amine has a molecular weight of 236.39 g/mol, XLogP of 0.19, 10 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[dimethoxy-[3-(methylamino)propoxy]silyl]propan-1-amine is sourced from PubChem (CID 87114848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).