3-[dimethoxy(phenyl)silyl]-N,N-bis[3-[dimethoxy(phenyl)silyl]propyl]propan-1-amine

C33H51NO6Si3 — CID 54289355

IUPAC3-[dimethoxy(phenyl)silyl]-N,N-bis[3-[dimethoxy(phenyl)silyl]propyl]propan-1-amine
SMILESCO[Si](CCCN(CCC[Si](OC)(OC)c1ccccc1)CCC[Si](OC)(OC)c1ccccc1)(OC)c1ccccc1
InChIInChI=1S/C33H51NO6Si3/c1-35-41(36-2,31-19-10-7-11-20-31)28-16-25-34(26-17-29-42(37-3,38-4)32-21-12-8-13-22-32)27-18-30-43(39-5,40-6)33-23-14-9-15-24-33/h7-15,19-24H,16-18,25-30H2,1-6H3
InChIKeyRWKJHMHJTNVKFP-UHFFFAOYSA-N
MW642.03 g/mol
LogP4.39
Rot. Bonds21

About 3-[dimethoxy(phenyl)silyl]-N,N-bis[3-[dimethoxy(phenyl)silyl]propyl]propan-1-amine

3-[dimethoxy(phenyl)silyl]-N,N-bis[3-[dimethoxy(phenyl)silyl]propyl]propan-1-amine (PubChem CID 54289355) has the molecular formula C33H51NO6Si3 and a molecular weight of 642.03 g/mol. Its IUPAC name is 3-[dimethoxy(phenyl)silyl]-N,N-bis[3-[dimethoxy(phenyl)silyl]propyl]propan-1-amine.

Molecular Properties

Compound Name3-[dimethoxy(phenyl)silyl]-N,N-bis[3-[dimethoxy(phenyl)silyl]propyl]propan-1-amine
PubChem CID54289355
Molecular FormulaC33H51NO6Si3
Molecular Weight642.03 g/mol
Exact Mass641.30
IUPAC Name3-[dimethoxy(phenyl)silyl]-N,N-bis[3-[dimethoxy(phenyl)silyl]propyl]propan-1-amine
SMILESCO[Si](CCCN(CCC[Si](OC)(OC)c1ccccc1)CCC[Si](OC)(OC)c1ccccc1)(OC)c1ccccc1
InChIInChI=1S/C33H51NO6Si3/c1-35-41(36-2,31-19-10-7-11-20-31)28-16-25-34(26-17-29-42(37-3,38-4)32-21-12-8-13-22-32)27-18-30-43(39-5,40-6)33-23-14-9-15-24-33/h7-15,19-24H,16-18,25-30H2,1-6H3
InChIKeyRWKJHMHJTNVKFP-UHFFFAOYSA-N
XLogP4.39
TPSA58.62 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds21
Heavy Atoms43
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500642.03
LogP ≤ 54.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze 3-[dimethoxy(phenyl)silyl]-N,N-bis[3-[dimethoxy(phenyl)silyl]propyl]propan-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

Tetrabutylammonium Difluorotriphenylsilicate
CID 9893474
N,N-Bis((diphenylphosphino)methyl)-3-(triethoxysilyl)propylamine
CID 102256625
Ethanamine, N,N'-[(1,1,5,5-tetramethyl-3,3-diphenyl-1,5-trisiloxanediyl)bis(oxy)]bis[N-ethyl-
CID 20836577
N,N-bis[3-[[4-[ethyl-methyl-(3-trimethoxysilylpropyl)silyl]phenyl]-dimethylsilyl]propyl]carbamoyl fluoride
CID 177125282
N,N-bis[3-[[4-[dimethyl(3-trimethoxysilylpropyl)silyl]phenyl]-dimethylsilyl]propyl]carbamoyl fluoride
CID 177125346
Tris(methyldiphenylsilylmethyl)amine
CID 129699529
1-(3-Dimethylaminopropyl)-1-t-butyl-3,3,5,5-tetraphenyl-2,4,6-trioxa-3,5-disila-1-stannacyclohexane
CID 129828604
N,N-bis(diphenylphosphanylmethyl)-3-[ethoxy(dimethoxy)silyl]propan-1-amine
CID 134939494
Molybdenum;oxido(triphenyl)silane;bis(oxygen(2-));tetraethylazanium;sulfide
CID 139138919
N,N-bis(diphenylphosphanylmethyl)-3-[ethoxy(dihydroxy)silyl]propan-1-amine;hydroxy(trimethyl)silane
CID 139211826
Pentacarbonyl[dimethylamino(triphenylsilyl)carbene]chromium(0)
CID 602646
Pentacarbonyl[diethylamino(triphenylsilyl)carbene]tungsten(0)
CID 602822

Frequently Asked Questions

What is the IUPAC name of 3-[dimethoxy(phenyl)silyl]-N,N-bis[3-[dimethoxy(phenyl)silyl]propyl]propan-1-amine?
The IUPAC name of 3-[dimethoxy(phenyl)silyl]-N,N-bis[3-[dimethoxy(phenyl)silyl]propyl]propan-1-amine (CID 54289355) is 3-[dimethoxy(phenyl)silyl]-N,N-bis[3-[dimethoxy(phenyl)silyl]propyl]propan-1-amine.
What is the SMILES notation for 3-[dimethoxy(phenyl)silyl]-N,N-bis[3-[dimethoxy(phenyl)silyl]propyl]propan-1-amine?
The canonical SMILES for 3-[dimethoxy(phenyl)silyl]-N,N-bis[3-[dimethoxy(phenyl)silyl]propyl]propan-1-amine is CO[Si](CCCN(CCC[Si](OC)(OC)c1ccccc1)CCC[Si](OC)(OC)c1ccccc1)(OC)c1ccccc1.
What is the InChIKey of 3-[dimethoxy(phenyl)silyl]-N,N-bis[3-[dimethoxy(phenyl)silyl]propyl]propan-1-amine?
The InChIKey is RWKJHMHJTNVKFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H51NO6Si3/c1-35-41(36-2,31-19-10-7-11-20-31)28-16-25-34(26-17-29-42(37-3,38-4)32-21-12-8-13-22-32)27-18-30-43(39-5,40-6)33-23-14-9-15-24-33/h7-15,19-24H,16-18,25-30H2,1-6H3.
What are the key properties of 3-[dimethoxy(phenyl)silyl]-N,N-bis[3-[dimethoxy(phenyl)silyl]propyl]propan-1-amine?
3-[dimethoxy(phenyl)silyl]-N,N-bis[3-[dimethoxy(phenyl)silyl]propyl]propan-1-amine has a molecular weight of 642.03 g/mol, XLogP of 4.39, 21 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[dimethoxy(phenyl)silyl]-N,N-bis[3-[dimethoxy(phenyl)silyl]propyl]propan-1-amine is sourced from PubChem (CID 54289355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).