3-[dimethoxy(undecyl)silyl]oxypropan-1-amine

C16H37NO3Si — CID 156751574

IUPAC3-[dimethoxy(undecyl)silyl]oxypropan-1-amine
SMILESCCCCCCCCCCC[Si](OC)(OC)OCCCN
InChIInChI=1S/C16H37NO3Si/c1-4-5-6-7-8-9-10-11-12-16-21(18-2,19-3)20-15-13-14-17/h4-17H2,1-3H3
InChIKeyMXZZEHHYZBSEHM-UHFFFAOYSA-N
MW319.56 g/mol
LogP4.11
Rot. Bonds16

About 3-[dimethoxy(undecyl)silyl]oxypropan-1-amine

3-[dimethoxy(undecyl)silyl]oxypropan-1-amine (PubChem CID 156751574) has the molecular formula C16H37NO3Si and a molecular weight of 319.56 g/mol. Its IUPAC name is 3-[dimethoxy(undecyl)silyl]oxypropan-1-amine.

Molecular Properties

Compound Name3-[dimethoxy(undecyl)silyl]oxypropan-1-amine
PubChem CID156751574
Molecular FormulaC16H37NO3Si
Molecular Weight319.56 g/mol
Exact Mass319.25
IUPAC Name3-[dimethoxy(undecyl)silyl]oxypropan-1-amine
SMILESCCCCCCCCCCC[Si](OC)(OC)OCCCN
InChIInChI=1S/C16H37NO3Si/c1-4-5-6-7-8-9-10-11-12-16-21(18-2,19-3)20-15-13-14-17/h4-17H2,1-3H3
InChIKeyMXZZEHHYZBSEHM-UHFFFAOYSA-N
XLogP4.11
TPSA53.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds16
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.56
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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

6-tripentoxysilylhexan-1-amine
CID 152508476
3-trihexadecoxysilylpropan-1-amine
CID 87405617
butoxy-butyl-dimethoxysilane
CID 139714527
hexane;bis(hexyl(trimethoxy)silane)
CID 175053771
trimethoxy(pentacontyl)silane
CID 87930715
hexacosyl(trimethoxy)silane
CID 150262252
dodecyl(trimethoxy)silane;octane
CID 174570785
decyl(trimethoxy)silane;hexyl(trimethoxy)silane
CID 22665206
trimethoxy(undecyl)silane;hydrobromide
CID 172731268
dodecyl(trimethoxy)silane;λ2-plumbane
CID 175120013
2-bromoethoxy-dimethoxy-pentylsilane
CID 142614027
3-[heptoxy(dimethoxy)silyl]propane-1,1-diamine
CID 163213327

Frequently Asked Questions

What is the IUPAC name of 3-[dimethoxy(undecyl)silyl]oxypropan-1-amine?
The IUPAC name of 3-[dimethoxy(undecyl)silyl]oxypropan-1-amine (CID 156751574) is 3-[dimethoxy(undecyl)silyl]oxypropan-1-amine.
What is the SMILES notation for 3-[dimethoxy(undecyl)silyl]oxypropan-1-amine?
The canonical SMILES for 3-[dimethoxy(undecyl)silyl]oxypropan-1-amine is CCCCCCCCCCC[Si](OC)(OC)OCCCN.
What is the InChIKey of 3-[dimethoxy(undecyl)silyl]oxypropan-1-amine?
The InChIKey is MXZZEHHYZBSEHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H37NO3Si/c1-4-5-6-7-8-9-10-11-12-16-21(18-2,19-3)20-15-13-14-17/h4-17H2,1-3H3.
What are the key properties of 3-[dimethoxy(undecyl)silyl]oxypropan-1-amine?
3-[dimethoxy(undecyl)silyl]oxypropan-1-amine has a molecular weight of 319.56 g/mol, XLogP of 4.11, 16 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[dimethoxy(undecyl)silyl]oxypropan-1-amine is sourced from PubChem (CID 156751574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).