N,N-bis(ethoxymethyl)-4-ethyl-4-silyloxyhexan-1-amine

C14H33NO3Si — CID 123801657

IUPACN,N-bis(ethoxymethyl)-4-ethyl-4-silyloxyhexan-1-amine
SMILESCCOCN(CCCC(CC)(CC)O[SiH3])COCC
InChIInChI=1S/C14H33NO3Si/c1-5-14(6-2,18-19)10-9-11-15(12-16-7-3)13-17-8-4/h5-13H2,1-4,19H3
InChIKeyIBBVIXKQZUEENE-UHFFFAOYSA-N
MW291.51 g/mol
LogP1.91
Rot. Bonds13

About N,N-bis(ethoxymethyl)-4-ethyl-4-silyloxyhexan-1-amine

N,N-bis(ethoxymethyl)-4-ethyl-4-silyloxyhexan-1-amine (PubChem CID 123801657) has the molecular formula C14H33NO3Si and a molecular weight of 291.51 g/mol. Its IUPAC name is N,N-bis(ethoxymethyl)-4-ethyl-4-silyloxyhexan-1-amine.

Molecular Properties

Compound NameN,N-bis(ethoxymethyl)-4-ethyl-4-silyloxyhexan-1-amine
PubChem CID123801657
Molecular FormulaC14H33NO3Si
Molecular Weight291.51 g/mol
Exact Mass291.22
IUPAC NameN,N-bis(ethoxymethyl)-4-ethyl-4-silyloxyhexan-1-amine
SMILESCCOCN(CCCC(CC)(CC)O[SiH3])COCC
InChIInChI=1S/C14H33NO3Si/c1-5-14(6-2,18-19)10-9-11-15(12-16-7-3)13-17-8-4/h5-13H2,1-4,19H3
InChIKeyIBBVIXKQZUEENE-UHFFFAOYSA-N
XLogP1.91
TPSA30.93 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.51
LogP ≤ 51.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N,N-bis(ethoxymethyl)-4-ethyl-4-silyloxyhexan-1-amine?
The IUPAC name of N,N-bis(ethoxymethyl)-4-ethyl-4-silyloxyhexan-1-amine (CID 123801657) is N,N-bis(ethoxymethyl)-4-ethyl-4-silyloxyhexan-1-amine.
What is the SMILES notation for N,N-bis(ethoxymethyl)-4-ethyl-4-silyloxyhexan-1-amine?
The canonical SMILES for N,N-bis(ethoxymethyl)-4-ethyl-4-silyloxyhexan-1-amine is CCOCN(CCCC(CC)(CC)O[SiH3])COCC.
What is the InChIKey of N,N-bis(ethoxymethyl)-4-ethyl-4-silyloxyhexan-1-amine?
The InChIKey is IBBVIXKQZUEENE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H33NO3Si/c1-5-14(6-2,18-19)10-9-11-15(12-16-7-3)13-17-8-4/h5-13H2,1-4,19H3.
What are the key properties of N,N-bis(ethoxymethyl)-4-ethyl-4-silyloxyhexan-1-amine?
N,N-bis(ethoxymethyl)-4-ethyl-4-silyloxyhexan-1-amine has a molecular weight of 291.51 g/mol, XLogP of 1.91, 13 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(ethoxymethyl)-4-ethyl-4-silyloxyhexan-1-amine is sourced from PubChem (CID 123801657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).