1-(2-methoxyethoxy)-N,5-dimethylhex-4-en-3-amine

C11H23NO2 — CID 102928161

IUPAC1-(2-methoxyethoxy)-N,5-dimethylhex-4-en-3-amine
SMILESCNC(C=C(C)C)CCOCCOC
InChIInChI=1S/C11H23NO2/c1-10(2)9-11(12-3)5-6-14-8-7-13-4/h9,11-12H,5-8H2,1-4H3
InChIKeyAIMKXHNLJGYDIQ-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.59
Rot. Bonds8

About 1-(2-methoxyethoxy)-N,5-dimethylhex-4-en-3-amine

1-(2-methoxyethoxy)-N,5-dimethylhex-4-en-3-amine (PubChem CID 102928161) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is 1-(2-methoxyethoxy)-N,5-dimethylhex-4-en-3-amine.

Molecular Properties

Compound Name1-(2-methoxyethoxy)-N,5-dimethylhex-4-en-3-amine
PubChem CID102928161
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Name1-(2-methoxyethoxy)-N,5-dimethylhex-4-en-3-amine
SMILESCNC(C=C(C)C)CCOCCOC
InChIInChI=1S/C11H23NO2/c1-10(2)9-11(12-3)5-6-14-8-7-13-4/h9,11-12H,5-8H2,1-4H3
InChIKeyAIMKXHNLJGYDIQ-UHFFFAOYSA-N
XLogP1.59
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethoxy)-N,5-dimethylhex-4-en-3-amine?
The IUPAC name of 1-(2-methoxyethoxy)-N,5-dimethylhex-4-en-3-amine (CID 102928161) is 1-(2-methoxyethoxy)-N,5-dimethylhex-4-en-3-amine.
What is the SMILES notation for 1-(2-methoxyethoxy)-N,5-dimethylhex-4-en-3-amine?
The canonical SMILES for 1-(2-methoxyethoxy)-N,5-dimethylhex-4-en-3-amine is CNC(C=C(C)C)CCOCCOC.
What is the InChIKey of 1-(2-methoxyethoxy)-N,5-dimethylhex-4-en-3-amine?
The InChIKey is AIMKXHNLJGYDIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-10(2)9-11(12-3)5-6-14-8-7-13-4/h9,11-12H,5-8H2,1-4H3.
What are the key properties of 1-(2-methoxyethoxy)-N,5-dimethylhex-4-en-3-amine?
1-(2-methoxyethoxy)-N,5-dimethylhex-4-en-3-amine has a molecular weight of 201.31 g/mol, XLogP of 1.59, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethoxy)-N,5-dimethylhex-4-en-3-amine is sourced from PubChem (CID 102928161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).