N-(6-aminohexyl)-3-trimethoxysilylpropanamide

C12H28N2O4Si — CID 59561256

IUPACN-(6-aminohexyl)-3-trimethoxysilylpropanamide
SMILESCO[Si](CCC(=O)NCCCCCCN)(OC)OC
InChIInChI=1S/C12H28N2O4Si/c1-16-19(17-2,18-3)11-8-12(15)14-10-7-5-4-6-9-13/h4-11,13H2,1-3H3,(H,14,15)
InChIKeyYMPYONDKZRPSNW-UHFFFAOYSA-N
MW292.45 g/mol
LogP0.89
Rot. Bonds12

About N-(6-aminohexyl)-3-trimethoxysilylpropanamide

N-(6-aminohexyl)-3-trimethoxysilylpropanamide (PubChem CID 59561256) has the molecular formula C12H28N2O4Si and a molecular weight of 292.45 g/mol. Its IUPAC name is N-(6-aminohexyl)-3-trimethoxysilylpropanamide.

Molecular Properties

Compound NameN-(6-aminohexyl)-3-trimethoxysilylpropanamide
PubChem CID59561256
Molecular FormulaC12H28N2O4Si
Molecular Weight292.45 g/mol
Exact Mass292.18
IUPAC NameN-(6-aminohexyl)-3-trimethoxysilylpropanamide
SMILESCO[Si](CCC(=O)NCCCCCCN)(OC)OC
InChIInChI=1S/C12H28N2O4Si/c1-16-19(17-2,18-3)11-8-12(15)14-10-7-5-4-6-9-13/h4-11,13H2,1-3H3,(H,14,15)
InChIKeyYMPYONDKZRPSNW-UHFFFAOYSA-N
XLogP0.89
TPSA82.81 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds12
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.45
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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-amino-N-(7-aminoheptyl)hexanamide
CID 56980494
N,N'-bis(12-aminododecyl)octanediamide
CID 58602052
N,N'-bis(7-aminoheptyl)pentanediamide
CID 86136288
N'-(6-aminohexyl)-N-methylbutanediamide
CID 155220266
7-amino-N-(3-methoxypropyl)heptanamide
CID 43153320
N-(3-trimethoxysilylpropyl)tricosanamide
CID 175992989
N-(3-trimethoxysilylpropyl)octanamide
CID 71362207
N-(6-aminohexyl)dodecanamide
CID 13030555
5-amino-N-(11-oxododecyl)pentanamide
CID 171093439
5-amino-N-[5-(propanoylamino)pentyl]pentanamide
CID 170966361
N-(6-aminohexyl)-1-trimethoxysilylformamide
CID 90878364
N-(4-aminobutyl)tetracosanamide
CID 171117181

Frequently Asked Questions

What is the IUPAC name of N-(6-aminohexyl)-3-trimethoxysilylpropanamide?
The IUPAC name of N-(6-aminohexyl)-3-trimethoxysilylpropanamide (CID 59561256) is N-(6-aminohexyl)-3-trimethoxysilylpropanamide.
What is the SMILES notation for N-(6-aminohexyl)-3-trimethoxysilylpropanamide?
The canonical SMILES for N-(6-aminohexyl)-3-trimethoxysilylpropanamide is CO[Si](CCC(=O)NCCCCCCN)(OC)OC.
What is the InChIKey of N-(6-aminohexyl)-3-trimethoxysilylpropanamide?
The InChIKey is YMPYONDKZRPSNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28N2O4Si/c1-16-19(17-2,18-3)11-8-12(15)14-10-7-5-4-6-9-13/h4-11,13H2,1-3H3,(H,14,15).
What are the key properties of N-(6-aminohexyl)-3-trimethoxysilylpropanamide?
N-(6-aminohexyl)-3-trimethoxysilylpropanamide has a molecular weight of 292.45 g/mol, XLogP of 0.89, 12 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-aminohexyl)-3-trimethoxysilylpropanamide is sourced from PubChem (CID 59561256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).