N,N-bis(2-ethoxyethyl)-3-trimethoxysilylpropan-1-amine

C14H33NO5Si — CID 87133007

IUPACN,N-bis(2-ethoxyethyl)-3-trimethoxysilylpropan-1-amine
SMILESCCOCCN(CCC[Si](OC)(OC)OC)CCOCC
InChIInChI=1S/C14H33NO5Si/c1-6-19-12-10-15(11-13-20-7-2)9-8-14-21(16-3,17-4)18-5/h6-14H2,1-5H3
InChIKeyDZLPRJTVEVXCAU-UHFFFAOYSA-N
MW323.51 g/mol
LogP1.63
Rot. Bonds15

About N,N-bis(2-ethoxyethyl)-3-trimethoxysilylpropan-1-amine

N,N-bis(2-ethoxyethyl)-3-trimethoxysilylpropan-1-amine (PubChem CID 87133007) has the molecular formula C14H33NO5Si and a molecular weight of 323.51 g/mol. Its IUPAC name is N,N-bis(2-ethoxyethyl)-3-trimethoxysilylpropan-1-amine.

Molecular Properties

Compound NameN,N-bis(2-ethoxyethyl)-3-trimethoxysilylpropan-1-amine
PubChem CID87133007
Molecular FormulaC14H33NO5Si
Molecular Weight323.51 g/mol
Exact Mass323.21
IUPAC NameN,N-bis(2-ethoxyethyl)-3-trimethoxysilylpropan-1-amine
SMILESCCOCCN(CCC[Si](OC)(OC)OC)CCOCC
InChIInChI=1S/C14H33NO5Si/c1-6-19-12-10-15(11-13-20-7-2)9-8-14-21(16-3,17-4)18-5/h6-14H2,1-5H3
InChIKeyDZLPRJTVEVXCAU-UHFFFAOYSA-N
XLogP1.63
TPSA49.39 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds15
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.51
LogP ≤ 51.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N-bis(2-ethoxyethyl)-3-trimethoxysilylpropan-1-amine?
The IUPAC name of N,N-bis(2-ethoxyethyl)-3-trimethoxysilylpropan-1-amine (CID 87133007) is N,N-bis(2-ethoxyethyl)-3-trimethoxysilylpropan-1-amine.
What is the SMILES notation for N,N-bis(2-ethoxyethyl)-3-trimethoxysilylpropan-1-amine?
The canonical SMILES for N,N-bis(2-ethoxyethyl)-3-trimethoxysilylpropan-1-amine is CCOCCN(CCC[Si](OC)(OC)OC)CCOCC.
What is the InChIKey of N,N-bis(2-ethoxyethyl)-3-trimethoxysilylpropan-1-amine?
The InChIKey is DZLPRJTVEVXCAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H33NO5Si/c1-6-19-12-10-15(11-13-20-7-2)9-8-14-21(16-3,17-4)18-5/h6-14H2,1-5H3.
What are the key properties of N,N-bis(2-ethoxyethyl)-3-trimethoxysilylpropan-1-amine?
N,N-bis(2-ethoxyethyl)-3-trimethoxysilylpropan-1-amine has a molecular weight of 323.51 g/mol, XLogP of 1.63, 15 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(2-ethoxyethyl)-3-trimethoxysilylpropan-1-amine is sourced from PubChem (CID 87133007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).