N-methyl-N-(3-trimethoxysilylpropyl)decan-1-amine;hydroiodide

C17H40INO3Si — CID 174161924

IUPACN-methyl-N-(3-trimethoxysilylpropyl)decan-1-amine;hydroiodide
SMILESCCCCCCCCCCN(C)CCC[Si](OC)(OC)OC.I
InChIInChI=1S/C17H39NO3Si.HI/c1-6-7-8-9-10-11-12-13-15-18(2)16-14-17-22(19-3,20-4)21-5;/h6-17H2,1-5H3;1H
InChIKeyFQTKENNLTPYDKI-UHFFFAOYSA-N
MW461.50 g/mol
LogP4.95
Rot. Bonds16

About N-methyl-N-(3-trimethoxysilylpropyl)decan-1-amine;hydroiodide

N-methyl-N-(3-trimethoxysilylpropyl)decan-1-amine;hydroiodide (PubChem CID 174161924) has the molecular formula C17H40INO3Si and a molecular weight of 461.50 g/mol. Its IUPAC name is N-methyl-N-(3-trimethoxysilylpropyl)decan-1-amine;hydroiodide.

Molecular Properties

Compound NameN-methyl-N-(3-trimethoxysilylpropyl)decan-1-amine;hydroiodide
PubChem CID174161924
Molecular FormulaC17H40INO3Si
Molecular Weight461.50 g/mol
Exact Mass461.18
IUPAC NameN-methyl-N-(3-trimethoxysilylpropyl)decan-1-amine;hydroiodide
SMILESCCCCCCCCCCN(C)CCC[Si](OC)(OC)OC.I
InChIInChI=1S/C17H39NO3Si.HI/c1-6-7-8-9-10-11-12-13-15-18(2)16-14-17-22(19-3,20-4)21-5;/h6-17H2,1-5H3;1H
InChIKeyFQTKENNLTPYDKI-UHFFFAOYSA-N
XLogP4.95
TPSA30.93 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds16
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500461.50
LogP ≤ 54.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-methyl-N-(3-trimethoxysilylpropyl)decan-1-amine;hydroiodide 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

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
N-hexyl-N-methyldodecan-1-amine
CID 139978744
N-methyl-N-octadecyloctadecan-1-amine;N-methyl-N-tetradecyltetradecan-1-amine
CID 172776346
N-methyl-N-nonylundecan-1-amine
CID 603442
N-methyl-N-tridecyltetradecan-1-amine
CID 87351995
N-methyl-N-octylundecan-1-amine
CID 140654810
N,N'-dimethyl-N,N'-dioctyldecane-1,10-diamine
CID 19772875
N-hexadecyl-N-methylicosan-1-amine
CID 21242596

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(3-trimethoxysilylpropyl)decan-1-amine;hydroiodide?
The IUPAC name of N-methyl-N-(3-trimethoxysilylpropyl)decan-1-amine;hydroiodide (CID 174161924) is N-methyl-N-(3-trimethoxysilylpropyl)decan-1-amine;hydroiodide.
What is the SMILES notation for N-methyl-N-(3-trimethoxysilylpropyl)decan-1-amine;hydroiodide?
The canonical SMILES for N-methyl-N-(3-trimethoxysilylpropyl)decan-1-amine;hydroiodide is CCCCCCCCCCN(C)CCC[Si](OC)(OC)OC.I.
What is the InChIKey of N-methyl-N-(3-trimethoxysilylpropyl)decan-1-amine;hydroiodide?
The InChIKey is FQTKENNLTPYDKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H39NO3Si.HI/c1-6-7-8-9-10-11-12-13-15-18(2)16-14-17-22(19-3,20-4)21-5;/h6-17H2,1-5H3;1H.
What are the key properties of N-methyl-N-(3-trimethoxysilylpropyl)decan-1-amine;hydroiodide?
N-methyl-N-(3-trimethoxysilylpropyl)decan-1-amine;hydroiodide has a molecular weight of 461.50 g/mol, XLogP of 4.95, 16 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(3-trimethoxysilylpropyl)decan-1-amine;hydroiodide is sourced from PubChem (CID 174161924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).