N,N-bis(ethoxymethyl)ethanamine

C8H19NO2 — CID 15778651

IUPACN,N-bis(ethoxymethyl)ethanamine
SMILESCCOCN(CC)COCC
InChIInChI=1S/C8H19NO2/c1-4-9(7-10-5-2)8-11-6-3/h4-8H2,1-3H3
InChIKeyYOYTYETTXGMJEU-UHFFFAOYSA-N
MW161.25 g/mol
LogP1.30
Rot. Bonds7

About N,N-bis(ethoxymethyl)ethanamine

N,N-bis(ethoxymethyl)ethanamine (PubChem CID 15778651) has the molecular formula C8H19NO2 and a molecular weight of 161.25 g/mol. Its IUPAC name is N,N-bis(ethoxymethyl)ethanamine.

Molecular Properties

Compound NameN,N-bis(ethoxymethyl)ethanamine
PubChem CID15778651
Molecular FormulaC8H19NO2
Molecular Weight161.25 g/mol
Exact Mass161.14
IUPAC NameN,N-bis(ethoxymethyl)ethanamine
SMILESCCOCN(CC)COCC
InChIInChI=1S/C8H19NO2/c1-4-9(7-10-5-2)8-11-6-3/h4-8H2,1-3H3
InChIKeyYOYTYETTXGMJEU-UHFFFAOYSA-N
XLogP1.30
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.25
LogP ≤ 51.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'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)ethanamine?
The IUPAC name of N,N-bis(ethoxymethyl)ethanamine (CID 15778651) is N,N-bis(ethoxymethyl)ethanamine.
What is the SMILES notation for N,N-bis(ethoxymethyl)ethanamine?
The canonical SMILES for N,N-bis(ethoxymethyl)ethanamine is CCOCN(CC)COCC.
What is the InChIKey of N,N-bis(ethoxymethyl)ethanamine?
The InChIKey is YOYTYETTXGMJEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO2/c1-4-9(7-10-5-2)8-11-6-3/h4-8H2,1-3H3.
What are the key properties of N,N-bis(ethoxymethyl)ethanamine?
N,N-bis(ethoxymethyl)ethanamine has a molecular weight of 161.25 g/mol, XLogP of 1.30, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(ethoxymethyl)ethanamine is sourced from PubChem (CID 15778651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).