N-ethyl-N-(propan-2-yloxymethyl)ethanamine

C8H19NO — CID 535576

IUPACN-ethyl-N-(propan-2-yloxymethyl)ethanamine
SMILESCCN(CC)COC(C)C
InChIInChI=1S/C8H19NO/c1-5-9(6-2)7-10-8(3)4/h8H,5-7H2,1-4H3
InChIKeyDYDOBQCNGFPQDY-UHFFFAOYSA-N
MW145.25 g/mol
LogP1.71
Rot. Bonds5

About N-ethyl-N-(propan-2-yloxymethyl)ethanamine

N-ethyl-N-(propan-2-yloxymethyl)ethanamine (PubChem CID 535576) has the molecular formula C8H19NO and a molecular weight of 145.25 g/mol. Its IUPAC name is N-ethyl-N-(propan-2-yloxymethyl)ethanamine.

Molecular Properties

Compound NameN-ethyl-N-(propan-2-yloxymethyl)ethanamine
PubChem CID535576
Molecular FormulaC8H19NO
Molecular Weight145.25 g/mol
Exact Mass145.15
IUPAC NameN-ethyl-N-(propan-2-yloxymethyl)ethanamine
SMILESCCN(CC)COC(C)C
InChIInChI=1S/C8H19NO/c1-5-9(6-2)7-10-8(3)4/h8H,5-7H2,1-4H3
InChIKeyDYDOBQCNGFPQDY-UHFFFAOYSA-N
XLogP1.71
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.25
LogP ≤ 51.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(Ethoxymethyl)diethylamine
CID 81812
N-(Butoxymethyl)-N-ethylethanamine
CID 12610255
1-Butan-2-yloxy-N,N-diethyl-methanethioamide
CID 185136
Triethyl(1,1,1,3,3,3-hexafluoropropan-2-yloxymethyl)azanium
CID 57074527
N,N-diethyl-4-methoxypent-2-yn-1-amine
CID 12537154
(Ethoxymethyl)triethylammonium iodide
CID 3026619
Ethoxymethyl(triethyl)azanium
CID 3026620
N-(Ethoxymethyl)-N-isopropylpropan-2-amine
CID 12346638
N-butyl-N-(ethoxymethyl)butan-1-amine
CID 13285800
N-(ethoxymethyl)-N-propylpropan-1-amine
CID 13573568
1-(Propan-2-yloxymethyl)pyrrolidine
CID 13693945
N-(cyclopentyloxymethyl)-N-ethylethanamine
CID 13805093

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(propan-2-yloxymethyl)ethanamine?
The IUPAC name of N-ethyl-N-(propan-2-yloxymethyl)ethanamine (CID 535576) is N-ethyl-N-(propan-2-yloxymethyl)ethanamine.
What is the SMILES notation for N-ethyl-N-(propan-2-yloxymethyl)ethanamine?
The canonical SMILES for N-ethyl-N-(propan-2-yloxymethyl)ethanamine is CCN(CC)COC(C)C.
What is the InChIKey of N-ethyl-N-(propan-2-yloxymethyl)ethanamine?
The InChIKey is DYDOBQCNGFPQDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO/c1-5-9(6-2)7-10-8(3)4/h8H,5-7H2,1-4H3.
What are the key properties of N-ethyl-N-(propan-2-yloxymethyl)ethanamine?
N-ethyl-N-(propan-2-yloxymethyl)ethanamine has a molecular weight of 145.25 g/mol, XLogP of 1.71, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(propan-2-yloxymethyl)ethanamine is sourced from PubChem (CID 535576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).