N-(2-ethoxyethyl)-N-ethyl-2-[(2-methoxyethylamino)methyl]aniline

C16H28N2O2 — CID 63690496

IUPACN-(2-ethoxyethyl)-N-ethyl-2-[(2-methoxyethylamino)methyl]aniline
SMILESCCOCCN(CC)c1ccccc1CNCCOC
InChIInChI=1S/C16H28N2O2/c1-4-18(11-13-20-5-2)16-9-7-6-8-15(16)14-17-10-12-19-3/h6-9,17H,4-5,10-14H2,1-3H3
InChIKeyODYHPXDILFJXML-UHFFFAOYSA-N
MW280.41 g/mol
LogP2.29
Rot. Bonds11

About N-(2-ethoxyethyl)-N-ethyl-2-[(2-methoxyethylamino)methyl]aniline

N-(2-ethoxyethyl)-N-ethyl-2-[(2-methoxyethylamino)methyl]aniline (PubChem CID 63690496) has the molecular formula C16H28N2O2 and a molecular weight of 280.41 g/mol. Its IUPAC name is N-(2-ethoxyethyl)-N-ethyl-2-[(2-methoxyethylamino)methyl]aniline.

Molecular Properties

Compound NameN-(2-ethoxyethyl)-N-ethyl-2-[(2-methoxyethylamino)methyl]aniline
PubChem CID63690496
Molecular FormulaC16H28N2O2
Molecular Weight280.41 g/mol
Exact Mass280.22
IUPAC NameN-(2-ethoxyethyl)-N-ethyl-2-[(2-methoxyethylamino)methyl]aniline
SMILESCCOCCN(CC)c1ccccc1CNCCOC
InChIInChI=1S/C16H28N2O2/c1-4-18(11-13-20-5-2)16-9-7-6-8-15(16)14-17-10-12-19-3/h6-9,17H,4-5,10-14H2,1-3H3
InChIKeyODYHPXDILFJXML-UHFFFAOYSA-N
XLogP2.29
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.41
LogP ≤ 52.29
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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Related Compounds

N,N-diethyl-2-[(2-methoxyethylamino)methyl]aniline
CID 63058895
N'-ethyl-N'-[2-[(2-methoxyethylamino)methyl]phenyl]-N,N-dimethylpropane-1,3-diamine
CID 102995261
5-chloro-N-(2-ethoxyethyl)-N-ethyl-2-[(2-methoxyethylamino)methyl]aniline
CID 114851380
N-ethyl-2-[(2-methoxyethylamino)methyl]-N-propan-2-ylaniline
CID 63059826
N-(2-ethoxyethyl)-N-ethyl-2-fluoro-4-[(2-methoxyethylamino)methyl]aniline
CID 63691377
N'-ethyl-N-(2-methoxyethyl)-N'-(2-methylphenyl)ethane-1,2-diamine
CID 62575841
N'-ethyl-N-(2-methoxyethyl)-N'-(2-methylphenyl)propane-1,3-diamine
CID 62569298
N'-[2-[(2-methoxyethylamino)methyl]phenyl]-N,N,N'-trimethylpropane-1,3-diamine
CID 63699734
2-[(2-methoxyethylamino)methyl]-N-(2-methylpropyl)-N-propan-2-ylaniline
CID 63070903
N-cyclohexyl-N-ethyl-2-[(2-methoxyethylamino)methyl]aniline
CID 63059978
N'-ethyl-N-(2-methoxyethyl)-N'-naphthalen-1-ylethane-1,2-diamine
CID 62574394
4-chloro-N-(2-ethoxyethyl)-2-[(2-methoxyethylamino)methyl]-N-methylaniline
CID 114852817

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyethyl)-N-ethyl-2-[(2-methoxyethylamino)methyl]aniline?
The IUPAC name of N-(2-ethoxyethyl)-N-ethyl-2-[(2-methoxyethylamino)methyl]aniline (CID 63690496) is N-(2-ethoxyethyl)-N-ethyl-2-[(2-methoxyethylamino)methyl]aniline.
What is the SMILES notation for N-(2-ethoxyethyl)-N-ethyl-2-[(2-methoxyethylamino)methyl]aniline?
The canonical SMILES for N-(2-ethoxyethyl)-N-ethyl-2-[(2-methoxyethylamino)methyl]aniline is CCOCCN(CC)c1ccccc1CNCCOC.
What is the InChIKey of N-(2-ethoxyethyl)-N-ethyl-2-[(2-methoxyethylamino)methyl]aniline?
The InChIKey is ODYHPXDILFJXML-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O2/c1-4-18(11-13-20-5-2)16-9-7-6-8-15(16)14-17-10-12-19-3/h6-9,17H,4-5,10-14H2,1-3H3.
What are the key properties of N-(2-ethoxyethyl)-N-ethyl-2-[(2-methoxyethylamino)methyl]aniline?
N-(2-ethoxyethyl)-N-ethyl-2-[(2-methoxyethylamino)methyl]aniline has a molecular weight of 280.41 g/mol, XLogP of 2.29, 11 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyethyl)-N-ethyl-2-[(2-methoxyethylamino)methyl]aniline is sourced from PubChem (CID 63690496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).