N-propyl-1-triethoxysilylpropan-1-amine

C12H29NO3Si — CID 87094166

IUPACN-propyl-1-triethoxysilylpropan-1-amine
SMILESCCCNC(CC)[Si](OCC)(OCC)OCC
InChIInChI=1S/C12H29NO3Si/c1-6-11-13-12(7-2)17(14-8-3,15-9-4)16-10-5/h12-13H,6-11H2,1-5H3
InChIKeyOMPMFVNOZYSFOF-UHFFFAOYSA-N
MW263.45 g/mol
LogP2.35
Rot. Bonds11

About N-propyl-1-triethoxysilylpropan-1-amine

N-propyl-1-triethoxysilylpropan-1-amine (PubChem CID 87094166) has the molecular formula C12H29NO3Si and a molecular weight of 263.45 g/mol. Its IUPAC name is N-propyl-1-triethoxysilylpropan-1-amine.

Molecular Properties

Compound NameN-propyl-1-triethoxysilylpropan-1-amine
PubChem CID87094166
Molecular FormulaC12H29NO3Si
Molecular Weight263.45 g/mol
Exact Mass263.19
IUPAC NameN-propyl-1-triethoxysilylpropan-1-amine
SMILESCCCNC(CC)[Si](OCC)(OCC)OCC
InChIInChI=1S/C12H29NO3Si/c1-6-11-13-12(7-2)17(14-8-3,15-9-4)16-10-5/h12-13H,6-11H2,1-5H3
InChIKeyOMPMFVNOZYSFOF-UHFFFAOYSA-N
XLogP2.35
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.45
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-chloro-1-triethoxysilylpropan-1-amine
CID 175004161
acetic acid;N'-(1-triethoxysilylpropyl)ethane-1,2-diamine
CID 173156526
N-[1-[diethoxy(methyl)silyl]propyl]butan-1-amine
CID 175581846
2-chloro-N-(1-triethoxysilylpropyl)acetamide
CID 18353899
N-(1-trimethoxysilylpropyl)hexan-1-amine
CID 87290664
1-N'-[1-(1-triethoxysilylpropylamino)ethyl]ethane-1,1-diamine
CID 87217216
ethyl 2-(propylamino)butanoate
CID 60795885
3-methyl-N-propylhexadecan-4-amine
CID 63717053
1-ethoxy-N-propylbutan-2-amine
CID 62040391
3,3-dimethylbutan-2-yl(triethoxy)silane
CID 91365282
N-(1-ethoxyethyl)propan-1-amine
CID 23317827
N'-(2-methyl-1-triethoxysilylpropyl)ethane-1,2-diamine
CID 22359732

Frequently Asked Questions

What is the IUPAC name of N-propyl-1-triethoxysilylpropan-1-amine?
The IUPAC name of N-propyl-1-triethoxysilylpropan-1-amine (CID 87094166) is N-propyl-1-triethoxysilylpropan-1-amine.
What is the SMILES notation for N-propyl-1-triethoxysilylpropan-1-amine?
The canonical SMILES for N-propyl-1-triethoxysilylpropan-1-amine is CCCNC(CC)[Si](OCC)(OCC)OCC.
What is the InChIKey of N-propyl-1-triethoxysilylpropan-1-amine?
The InChIKey is OMPMFVNOZYSFOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H29NO3Si/c1-6-11-13-12(7-2)17(14-8-3,15-9-4)16-10-5/h12-13H,6-11H2,1-5H3.
What are the key properties of N-propyl-1-triethoxysilylpropan-1-amine?
N-propyl-1-triethoxysilylpropan-1-amine has a molecular weight of 263.45 g/mol, XLogP of 2.35, 11 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-1-triethoxysilylpropan-1-amine is sourced from PubChem (CID 87094166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).