3-(2-ethoxy-1-hydrazinylethyl)-N,N-dimethylaniline

C12H21N3O — CID 105321186

IUPAC3-(2-ethoxy-1-hydrazinylethyl)-N,N-dimethylaniline
SMILESCCOCC(NN)c1cccc(N(C)C)c1
InChIInChI=1S/C12H21N3O/c1-4-16-9-12(14-13)10-6-5-7-11(8-10)15(2)3/h5-8,12,14H,4,9,13H2,1-3H3
InChIKeyVHKGFOMBUILOCE-UHFFFAOYSA-N
MW223.32 g/mol
LogP1.29
Rot. Bonds6

About 3-(2-ethoxy-1-hydrazinylethyl)-N,N-dimethylaniline

3-(2-ethoxy-1-hydrazinylethyl)-N,N-dimethylaniline (PubChem CID 105321186) has the molecular formula C12H21N3O and a molecular weight of 223.32 g/mol. Its IUPAC name is 3-(2-ethoxy-1-hydrazinylethyl)-N,N-dimethylaniline.

Molecular Properties

Compound Name3-(2-ethoxy-1-hydrazinylethyl)-N,N-dimethylaniline
PubChem CID105321186
Molecular FormulaC12H21N3O
Molecular Weight223.32 g/mol
Exact Mass223.17
IUPAC Name3-(2-ethoxy-1-hydrazinylethyl)-N,N-dimethylaniline
SMILESCCOCC(NN)c1cccc(N(C)C)c1
InChIInChI=1S/C12H21N3O/c1-4-16-9-12(14-13)10-6-5-7-11(8-10)15(2)3/h5-8,12,14H,4,9,13H2,1-3H3
InChIKeyVHKGFOMBUILOCE-UHFFFAOYSA-N
XLogP1.29
TPSA50.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3-(1-amino-2-ethoxyethyl)-N,N-dimethylaniline
CID 105165045
3-(1-hydrazinylheptyl)-N,N-dimethylaniline
CID 105293942
3-[1-hydrazinyl-2-(4-iodophenyl)ethyl]-N,N-dimethylaniline
CID 105310254
[1-(3,4-dimethoxyphenyl)-2-ethoxyethyl]hydrazine
CID 105192155
3-[(3-ethylphenyl)-hydrazinylmethyl]-N,N-dimethylaniline
CID 105326250
3-[hydrazinyl(phenyl)methyl]-N,N-dimethylaniline
CID 105282900
[1-(4-chlorophenyl)-2-ethoxyethyl]hydrazine
CID 105193288
3-[1-(ethylamino)butyl]-N,N-dimethylaniline
CID 105080535
[1-(3-methoxyphenyl)-2-propoxyethyl]hydrazine
CID 105191587
[1-(2,6-dimethyl-4-pyridinyl)-2-ethoxyethyl]hydrazine
CID 107505001
3-[2-(4-bromo-2-chlorophenyl)-1-hydrazinylethyl]-N,N-dimethylaniline
CID 105335162
N,N-dimethyl-3-[1-(propylamino)butyl]aniline
CID 105080148

Frequently Asked Questions

What is the IUPAC name of 3-(2-ethoxy-1-hydrazinylethyl)-N,N-dimethylaniline?
The IUPAC name of 3-(2-ethoxy-1-hydrazinylethyl)-N,N-dimethylaniline (CID 105321186) is 3-(2-ethoxy-1-hydrazinylethyl)-N,N-dimethylaniline.
What is the SMILES notation for 3-(2-ethoxy-1-hydrazinylethyl)-N,N-dimethylaniline?
The canonical SMILES for 3-(2-ethoxy-1-hydrazinylethyl)-N,N-dimethylaniline is CCOCC(NN)c1cccc(N(C)C)c1.
What is the InChIKey of 3-(2-ethoxy-1-hydrazinylethyl)-N,N-dimethylaniline?
The InChIKey is VHKGFOMBUILOCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O/c1-4-16-9-12(14-13)10-6-5-7-11(8-10)15(2)3/h5-8,12,14H,4,9,13H2,1-3H3.
What are the key properties of 3-(2-ethoxy-1-hydrazinylethyl)-N,N-dimethylaniline?
3-(2-ethoxy-1-hydrazinylethyl)-N,N-dimethylaniline has a molecular weight of 223.32 g/mol, XLogP of 1.29, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-ethoxy-1-hydrazinylethyl)-N,N-dimethylaniline is sourced from PubChem (CID 105321186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).