N-ethoxy-2-(2-methoxyethoxy)aniline

C11H17NO3 — CID 57186576

IUPACN-ethoxy-2-(2-methoxyethoxy)aniline
SMILESCCONc1ccccc1OCCOC
InChIInChI=1S/C11H17NO3/c1-3-15-12-10-6-4-5-7-11(10)14-9-8-13-2/h4-7,12H,3,8-9H2,1-2H3
InChIKeyFLXGBKPNVMTKKM-UHFFFAOYSA-N
MW211.26 g/mol
LogP2.08
Rot. Bonds7

About N-ethoxy-2-(2-methoxyethoxy)aniline

N-ethoxy-2-(2-methoxyethoxy)aniline (PubChem CID 57186576) has the molecular formula C11H17NO3 and a molecular weight of 211.26 g/mol. Its IUPAC name is N-ethoxy-2-(2-methoxyethoxy)aniline.

Molecular Properties

Compound NameN-ethoxy-2-(2-methoxyethoxy)aniline
PubChem CID57186576
Molecular FormulaC11H17NO3
Molecular Weight211.26 g/mol
Exact Mass211.12
IUPAC NameN-ethoxy-2-(2-methoxyethoxy)aniline
SMILESCCONc1ccccc1OCCOC
InChIInChI=1S/C11H17NO3/c1-3-15-12-10-6-4-5-7-11(10)14-9-8-13-2/h4-7,12H,3,8-9H2,1-2H3
InChIKeyFLXGBKPNVMTKKM-UHFFFAOYSA-N
XLogP2.08
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2-ethoxyphenyl)-2-(2-methoxyethoxy)benzamide
CID 15943045
2-butoxy-N-[[2-(2-methoxyethoxy)phenyl]methyl]aniline
CID 54801593
2-(2-ethoxyphenoxy)-N-(2-methoxyethoxy)ethanamine
CID 82723021
1-(2-ethoxyphenyl)-3-(2-methoxyethyl)urea
CID 47032357
N-ethyl-2-(2-phenoxyethoxy)aniline
CID 54801094
2-[(2-ethoxyanilino)methyl]aniline
CID 66385823
2-(2-methoxyethoxy)-N-(2-propoxyphenyl)acetamide
CID 103606695
bis[2-(2-methoxyethoxy)phenyl]iodanium
CID 139829734
1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]benzene
CID 102202030
methyl N-(2-propoxyphenyl)carbamate
CID 19872099
N-[2-(2-chlorophenoxy)ethyl]-2-(2-ethoxyethoxy)aniline
CID 54801723
2-(2-ethoxyethoxy)-N-hexylaniline
CID 54801767

Frequently Asked Questions

What is the IUPAC name of N-ethoxy-2-(2-methoxyethoxy)aniline?
The IUPAC name of N-ethoxy-2-(2-methoxyethoxy)aniline (CID 57186576) is N-ethoxy-2-(2-methoxyethoxy)aniline.
What is the SMILES notation for N-ethoxy-2-(2-methoxyethoxy)aniline?
The canonical SMILES for N-ethoxy-2-(2-methoxyethoxy)aniline is CCONc1ccccc1OCCOC.
What is the InChIKey of N-ethoxy-2-(2-methoxyethoxy)aniline?
The InChIKey is FLXGBKPNVMTKKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO3/c1-3-15-12-10-6-4-5-7-11(10)14-9-8-13-2/h4-7,12H,3,8-9H2,1-2H3.
What are the key properties of N-ethoxy-2-(2-methoxyethoxy)aniline?
N-ethoxy-2-(2-methoxyethoxy)aniline has a molecular weight of 211.26 g/mol, XLogP of 2.08, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethoxy-2-(2-methoxyethoxy)aniline is sourced from PubChem (CID 57186576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).