N-methyl-N-(triethoxysilylmethyl)cyclohexanamine

C14H31NO3Si — CID 11219985

IUPACN-methyl-N-(triethoxysilylmethyl)cyclohexanamine
SMILESCCO[Si](CN(C)C1CCCCC1)(OCC)OCC
InChIInChI=1S/C14H31NO3Si/c1-5-16-19(17-6-2,18-7-3)13-15(4)14-11-9-8-10-12-14/h14H,5-13H2,1-4H3
InChIKeyUORUBBLHFXWXEP-UHFFFAOYSA-N
MW289.49 g/mol
LogP2.84
Rot. Bonds9

About N-methyl-N-(triethoxysilylmethyl)cyclohexanamine

N-methyl-N-(triethoxysilylmethyl)cyclohexanamine (PubChem CID 11219985) has the molecular formula C14H31NO3Si and a molecular weight of 289.49 g/mol. Its IUPAC name is N-methyl-N-(triethoxysilylmethyl)cyclohexanamine.

Molecular Properties

Compound NameN-methyl-N-(triethoxysilylmethyl)cyclohexanamine
PubChem CID11219985
Molecular FormulaC14H31NO3Si
Molecular Weight289.49 g/mol
Exact Mass289.21
IUPAC NameN-methyl-N-(triethoxysilylmethyl)cyclohexanamine
SMILESCCO[Si](CN(C)C1CCCCC1)(OCC)OCC
InChIInChI=1S/C14H31NO3Si/c1-5-16-19(17-6-2,18-7-3)13-15(4)14-11-9-8-10-12-14/h14H,5-13H2,1-4H3
InChIKeyUORUBBLHFXWXEP-UHFFFAOYSA-N
XLogP2.84
TPSA30.93 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.49
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(triethoxysilylmethyl)cyclohexanamine?
The IUPAC name of N-methyl-N-(triethoxysilylmethyl)cyclohexanamine (CID 11219985) is N-methyl-N-(triethoxysilylmethyl)cyclohexanamine.
What is the SMILES notation for N-methyl-N-(triethoxysilylmethyl)cyclohexanamine?
The canonical SMILES for N-methyl-N-(triethoxysilylmethyl)cyclohexanamine is CCO[Si](CN(C)C1CCCCC1)(OCC)OCC.
What is the InChIKey of N-methyl-N-(triethoxysilylmethyl)cyclohexanamine?
The InChIKey is UORUBBLHFXWXEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31NO3Si/c1-5-16-19(17-6-2,18-7-3)13-15(4)14-11-9-8-10-12-14/h14H,5-13H2,1-4H3.
What are the key properties of N-methyl-N-(triethoxysilylmethyl)cyclohexanamine?
N-methyl-N-(triethoxysilylmethyl)cyclohexanamine has a molecular weight of 289.49 g/mol, XLogP of 2.84, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(triethoxysilylmethyl)cyclohexanamine is sourced from PubChem (CID 11219985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).