N-[3-[diethoxy(methoxy)silyl]propyl]cyclohexanamine

C14H31NO3Si — CID 66781682

IUPACN-[3-[diethoxy(methoxy)silyl]propyl]cyclohexanamine
SMILESCCO[Si](CCCNC1CCCCC1)(OC)OCC
InChIInChI=1S/C14H31NO3Si/c1-4-17-19(16-3,18-5-2)13-9-12-15-14-10-7-6-8-11-14/h14-15H,4-13H2,1-3H3
InChIKeyRUTBGEATFXGNSD-UHFFFAOYSA-N
MW289.49 g/mol
LogP2.96
Rot. Bonds10

About N-[3-[diethoxy(methoxy)silyl]propyl]cyclohexanamine

N-[3-[diethoxy(methoxy)silyl]propyl]cyclohexanamine (PubChem CID 66781682) has the molecular formula C14H31NO3Si and a molecular weight of 289.49 g/mol. Its IUPAC name is N-[3-[diethoxy(methoxy)silyl]propyl]cyclohexanamine.

Molecular Properties

Compound NameN-[3-[diethoxy(methoxy)silyl]propyl]cyclohexanamine
PubChem CID66781682
Molecular FormulaC14H31NO3Si
Molecular Weight289.49 g/mol
Exact Mass289.21
IUPAC NameN-[3-[diethoxy(methoxy)silyl]propyl]cyclohexanamine
SMILESCCO[Si](CCCNC1CCCCC1)(OC)OCC
InChIInChI=1S/C14H31NO3Si/c1-4-17-19(16-3,18-5-2)13-9-12-15-14-10-7-6-8-11-14/h14-15H,4-13H2,1-3H3
InChIKeyRUTBGEATFXGNSD-UHFFFAOYSA-N
XLogP2.96
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.49
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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

N-(3-dimethoxysilylpropyl)cyclohexanamine;N-(3-trimethoxysilylpropyl)cyclohexanamine
CID 160784972
N-(3-tripropoxysilylpropyl)cyclohexanamine
CID 139879994
ethenyl-tris(2-methoxyethoxy)silane;N-(3-trimethoxysilylpropyl)cyclohexanamine
CID 172850782
4-N-[2-(propan-2-ylamino)ethyl]-1-N-(3-trimethoxysilylpropyl)cyclohexane-1,4-diamine
CID 23596606
N-[[dimethoxy(propyl)silyl]oxymethyl]cyclohexanamine
CID 70530574
N-(4-ethoxybutyl)cycloheptanamine
CID 112730026
N-butylcyclohexanamine;molecular hydrogen
CID 143047743
N-dodecylcyclohexanamine
CID 3679395
N'-(3-triethoxysilylpropyl)ethane-1,2-diamine;N'-(3-trimethoxysilylpropyl)ethane-1,2-diamine
CID 87775603
N-(5-methoxypentyl)cyclooctanamine
CID 115714847
N-[[diethoxy(methyl)silyl]methyl]cyclohexanamine
CID 18468764
N,N'-dicyclohexyloctane-1,8-diamine;dihydrochloride
CID 3029604

Frequently Asked Questions

What is the IUPAC name of N-[3-[diethoxy(methoxy)silyl]propyl]cyclohexanamine?
The IUPAC name of N-[3-[diethoxy(methoxy)silyl]propyl]cyclohexanamine (CID 66781682) is N-[3-[diethoxy(methoxy)silyl]propyl]cyclohexanamine.
What is the SMILES notation for N-[3-[diethoxy(methoxy)silyl]propyl]cyclohexanamine?
The canonical SMILES for N-[3-[diethoxy(methoxy)silyl]propyl]cyclohexanamine is CCO[Si](CCCNC1CCCCC1)(OC)OCC.
What is the InChIKey of N-[3-[diethoxy(methoxy)silyl]propyl]cyclohexanamine?
The InChIKey is RUTBGEATFXGNSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31NO3Si/c1-4-17-19(16-3,18-5-2)13-9-12-15-14-10-7-6-8-11-14/h14-15H,4-13H2,1-3H3.
What are the key properties of N-[3-[diethoxy(methoxy)silyl]propyl]cyclohexanamine?
N-[3-[diethoxy(methoxy)silyl]propyl]cyclohexanamine has a molecular weight of 289.49 g/mol, XLogP of 2.96, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[diethoxy(methoxy)silyl]propyl]cyclohexanamine is sourced from PubChem (CID 66781682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).