N-propyl-N-triethoxysilyl-3-trimethoxysilylpropan-1-amine

C15H37NO6Si2 — CID 87547282

IUPACN-propyl-N-triethoxysilyl-3-trimethoxysilylpropan-1-amine
SMILESCCCN(CCC[Si](OC)(OC)OC)[Si](OCC)(OCC)OCC
InChIInChI=1S/C15H37NO6Si2/c1-8-13-16(14-12-15-23(17-5,18-6)19-7)24(20-9-2,21-10-3)22-11-4/h8-15H2,1-7H3
InChIKeyFEKXMEHEMGKFQU-UHFFFAOYSA-N
MW383.63 g/mol
LogP2.51
Rot. Bonds16

About N-propyl-N-triethoxysilyl-3-trimethoxysilylpropan-1-amine

N-propyl-N-triethoxysilyl-3-trimethoxysilylpropan-1-amine (PubChem CID 87547282) has the molecular formula C15H37NO6Si2 and a molecular weight of 383.63 g/mol. Its IUPAC name is N-propyl-N-triethoxysilyl-3-trimethoxysilylpropan-1-amine.

Molecular Properties

Compound NameN-propyl-N-triethoxysilyl-3-trimethoxysilylpropan-1-amine
PubChem CID87547282
Molecular FormulaC15H37NO6Si2
Molecular Weight383.63 g/mol
Exact Mass383.22
IUPAC NameN-propyl-N-triethoxysilyl-3-trimethoxysilylpropan-1-amine
SMILESCCCN(CCC[Si](OC)(OC)OC)[Si](OCC)(OCC)OCC
InChIInChI=1S/C15H37NO6Si2/c1-8-13-16(14-12-15-23(17-5,18-6)19-7)24(20-9-2,21-10-3)22-11-4/h8-15H2,1-7H3
InChIKeyFEKXMEHEMGKFQU-UHFFFAOYSA-N
XLogP2.51
TPSA58.62 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds16
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.63
LogP ≤ 52.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze N-propyl-N-triethoxysilyl-3-trimethoxysilylpropan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-propyl-N-triethoxysilylbutan-1-amine
CID 175342889
N-propyl-3-triethoxysilyl-N-trimethylsilylpropan-1-amine
CID 90265370
N-propyl-N-trimethoxysilyloctadecan-1-amine;hydrochloride
CID 173034322
butyl(triethoxy)silane;trimethoxy(propyl)silane
CID 158050354
dodecyl-diethoxy-methoxysilane
CID 141483107
butyl-diethoxy-methoxysilane;molecular hydrogen
CID 161363700
heptadecyl(trimethoxy)silane;triethoxy(heptadecyl)silane
CID 161331020
2-[3-[diethoxy(methoxy)silyl]propyl-(3-triethoxysilylpropyl)amino]ethanol
CID 159716952
(Z)-N-propyl-N-trimethoxysilyloctadec-9-en-1-amine;hydrochloride
CID 173241581
N-ethyl-N-triethoxysilylethanamine
CID 14150693
N'-[2-[propyl(trimethoxysilyl)amino]ethyl]ethane-1,2-diamine
CID 53446485
N-methyl-N-(3-trimethoxysilylpropyl)decan-1-amine;hydroiodide
CID 174161924

Frequently Asked Questions

What is the IUPAC name of N-propyl-N-triethoxysilyl-3-trimethoxysilylpropan-1-amine?
The IUPAC name of N-propyl-N-triethoxysilyl-3-trimethoxysilylpropan-1-amine (CID 87547282) is N-propyl-N-triethoxysilyl-3-trimethoxysilylpropan-1-amine.
What is the SMILES notation for N-propyl-N-triethoxysilyl-3-trimethoxysilylpropan-1-amine?
The canonical SMILES for N-propyl-N-triethoxysilyl-3-trimethoxysilylpropan-1-amine is CCCN(CCC[Si](OC)(OC)OC)[Si](OCC)(OCC)OCC.
What is the InChIKey of N-propyl-N-triethoxysilyl-3-trimethoxysilylpropan-1-amine?
The InChIKey is FEKXMEHEMGKFQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H37NO6Si2/c1-8-13-16(14-12-15-23(17-5,18-6)19-7)24(20-9-2,21-10-3)22-11-4/h8-15H2,1-7H3.
What are the key properties of N-propyl-N-triethoxysilyl-3-trimethoxysilylpropan-1-amine?
N-propyl-N-triethoxysilyl-3-trimethoxysilylpropan-1-amine has a molecular weight of 383.63 g/mol, XLogP of 2.51, 16 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-N-triethoxysilyl-3-trimethoxysilylpropan-1-amine is sourced from PubChem (CID 87547282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).