N-ethyl-2-[(6-methoxy-2-pyridinyl)oxy]ethanamine

C10H16N2O2 — CID 63586299

IUPACN-ethyl-2-[(6-methoxy-2-pyridinyl)oxy]ethanamine
SMILESCCNCCOc1cccc(OC)n1
InChIInChI=1S/C10H16N2O2/c1-3-11-7-8-14-10-6-4-5-9(12-10)13-2/h4-6,11H,3,7-8H2,1-2H3
InChIKeyVRLTYQGISCLKIG-UHFFFAOYSA-N
MW196.25 g/mol
LogP1.08
Rot. Bonds6

About N-ethyl-2-[(6-methoxy-2-pyridinyl)oxy]ethanamine

N-ethyl-2-[(6-methoxy-2-pyridinyl)oxy]ethanamine (PubChem CID 63586299) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is N-ethyl-2-[(6-methoxy-2-pyridinyl)oxy]ethanamine.

Molecular Properties

Compound NameN-ethyl-2-[(6-methoxy-2-pyridinyl)oxy]ethanamine
PubChem CID63586299
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC NameN-ethyl-2-[(6-methoxy-2-pyridinyl)oxy]ethanamine
SMILESCCNCCOc1cccc(OC)n1
InChIInChI=1S/C10H16N2O2/c1-3-11-7-8-14-10-6-4-5-9(12-10)13-2/h4-6,11H,3,7-8H2,1-2H3
InChIKeyVRLTYQGISCLKIG-UHFFFAOYSA-N
XLogP1.08
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[(6-methoxy-2-pyridinyl)oxy]ethanamine?
The IUPAC name of N-ethyl-2-[(6-methoxy-2-pyridinyl)oxy]ethanamine (CID 63586299) is N-ethyl-2-[(6-methoxy-2-pyridinyl)oxy]ethanamine.
What is the SMILES notation for N-ethyl-2-[(6-methoxy-2-pyridinyl)oxy]ethanamine?
The canonical SMILES for N-ethyl-2-[(6-methoxy-2-pyridinyl)oxy]ethanamine is CCNCCOc1cccc(OC)n1.
What is the InChIKey of N-ethyl-2-[(6-methoxy-2-pyridinyl)oxy]ethanamine?
The InChIKey is VRLTYQGISCLKIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c1-3-11-7-8-14-10-6-4-5-9(12-10)13-2/h4-6,11H,3,7-8H2,1-2H3.
What are the key properties of N-ethyl-2-[(6-methoxy-2-pyridinyl)oxy]ethanamine?
N-ethyl-2-[(6-methoxy-2-pyridinyl)oxy]ethanamine has a molecular weight of 196.25 g/mol, XLogP of 1.08, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[(6-methoxy-2-pyridinyl)oxy]ethanamine is sourced from PubChem (CID 63586299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).