3-[[butyl(dihydroxy)silyl]oxy-dihydroxysilyl]propan-1-amine

C7H21NO5Si2 — CID 165097689

IUPAC3-[[butyl(dihydroxy)silyl]oxy-dihydroxysilyl]propan-1-amine
SMILESCCCC[Si](O)(O)O[Si](O)(O)CCCN
InChIInChI=1S/C7H21NO5Si2/c1-2-3-6-14(9,10)13-15(11,12)7-4-5-8/h9-12H,2-8H2,1H3
InChIKeyXUDDMPIVHUTQCB-UHFFFAOYSA-N
MW255.42 g/mol
LogP-1.00
Rot. Bonds8

About 3-[[butyl(dihydroxy)silyl]oxy-dihydroxysilyl]propan-1-amine

3-[[butyl(dihydroxy)silyl]oxy-dihydroxysilyl]propan-1-amine (PubChem CID 165097689) has the molecular formula C7H21NO5Si2 and a molecular weight of 255.42 g/mol. Its IUPAC name is 3-[[butyl(dihydroxy)silyl]oxy-dihydroxysilyl]propan-1-amine.

Molecular Properties

Compound Name3-[[butyl(dihydroxy)silyl]oxy-dihydroxysilyl]propan-1-amine
PubChem CID165097689
Molecular FormulaC7H21NO5Si2
Molecular Weight255.42 g/mol
Exact Mass255.10
IUPAC Name3-[[butyl(dihydroxy)silyl]oxy-dihydroxysilyl]propan-1-amine
SMILESCCCC[Si](O)(O)O[Si](O)(O)CCCN
InChIInChI=1S/C7H21NO5Si2/c1-2-3-6-14(9,10)13-15(11,12)7-4-5-8/h9-12H,2-8H2,1H3
InChIKeyXUDDMPIVHUTQCB-UHFFFAOYSA-N
XLogP-1.00
TPSA116.17 Ų
H-Bond Donors5
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.42
LogP ≤ 5-1.00
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

3-[[[3-aminopropyl-[3-aminopropyl(dihydroxy)silyl]oxy-hydroxysilyl]oxy-hydroxy-methylsilyl]oxy-dihydroxysilyl]propan-1-amine
CID 59903289
ethanol;bis(3-[ethoxy(dihydroxy)silyl]propan-1-amine);methane;bis(3-triethoxysilylpropan-1-amine)
CID 167608447
4-[butyl(dimethoxy)silyl]butan-1-amine
CID 88813037
3-[[[[butyl(dimethyl)silyl]oxy-ethynyl-methylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propan-1-amine;molecular hydrogen
CID 158811260
3-[propyl-bis(trimethylsilyloxy)silyl]propan-1-amine
CID 140893293
3-trihexadecoxysilylpropan-1-amine
CID 87405617
3-[hexyl(dimethyl)silyl]propan-1-amine
CID 139880015
CID 159237160
CID 159237160
3-[methyl-(methyl-propyl-trimethylsilyloxysilyl)oxy-trimethylsilyloxysilyl]propan-1-amine
CID 123147792
dodecan-1-amine;hydroxylamine
CID 175960605
trihydroxy-[octadecyl-bis(trihydroxysilyloxy)silyl]oxysilane
CID 101049224
3-[[3-aminopropyl-[3-aminopropyl(diethoxy)silyl]oxy-ethoxysilyl]oxy-diethoxysilyl]propan-1-amine
CID 143956342

Frequently Asked Questions

What is the IUPAC name of 3-[[butyl(dihydroxy)silyl]oxy-dihydroxysilyl]propan-1-amine?
The IUPAC name of 3-[[butyl(dihydroxy)silyl]oxy-dihydroxysilyl]propan-1-amine (CID 165097689) is 3-[[butyl(dihydroxy)silyl]oxy-dihydroxysilyl]propan-1-amine.
What is the SMILES notation for 3-[[butyl(dihydroxy)silyl]oxy-dihydroxysilyl]propan-1-amine?
The canonical SMILES for 3-[[butyl(dihydroxy)silyl]oxy-dihydroxysilyl]propan-1-amine is CCCC[Si](O)(O)O[Si](O)(O)CCCN.
What is the InChIKey of 3-[[butyl(dihydroxy)silyl]oxy-dihydroxysilyl]propan-1-amine?
The InChIKey is XUDDMPIVHUTQCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H21NO5Si2/c1-2-3-6-14(9,10)13-15(11,12)7-4-5-8/h9-12H,2-8H2,1H3.
What are the key properties of 3-[[butyl(dihydroxy)silyl]oxy-dihydroxysilyl]propan-1-amine?
3-[[butyl(dihydroxy)silyl]oxy-dihydroxysilyl]propan-1-amine has a molecular weight of 255.42 g/mol, XLogP of -1.00, 8 rotatable bonds, 5 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[butyl(dihydroxy)silyl]oxy-dihydroxysilyl]propan-1-amine is sourced from PubChem (CID 165097689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).