N,N-diethyl-2-[(2-methoxyethylamino)methyl]aniline

C14H24N2O — CID 63058895

IUPACN,N-diethyl-2-[(2-methoxyethylamino)methyl]aniline
SMILESCCN(CC)c1ccccc1CNCCOC
InChIInChI=1S/C14H24N2O/c1-4-16(5-2)14-9-7-6-8-13(14)12-15-10-11-17-3/h6-9,15H,4-5,10-12H2,1-3H3
InChIKeyPDGRQINCIMBVSE-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.27
Rot. Bonds8

About N,N-diethyl-2-[(2-methoxyethylamino)methyl]aniline

N,N-diethyl-2-[(2-methoxyethylamino)methyl]aniline (PubChem CID 63058895) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is N,N-diethyl-2-[(2-methoxyethylamino)methyl]aniline.

Molecular Properties

Compound NameN,N-diethyl-2-[(2-methoxyethylamino)methyl]aniline
PubChem CID63058895
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC NameN,N-diethyl-2-[(2-methoxyethylamino)methyl]aniline
SMILESCCN(CC)c1ccccc1CNCCOC
InChIInChI=1S/C14H24N2O/c1-4-16(5-2)14-9-7-6-8-13(14)12-15-10-11-17-3/h6-9,15H,4-5,10-12H2,1-3H3
InChIKeyPDGRQINCIMBVSE-UHFFFAOYSA-N
XLogP2.27
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N'-ethyl-N'-[2-[(2-methoxyethylamino)methyl]phenyl]-N,N-dimethylpropane-1,3-diamine
CID 102995261
N-(2-ethoxyethyl)-N-ethyl-2-[(2-methoxyethylamino)methyl]aniline
CID 63690496
N-ethyl-2-[(2-methoxyethylamino)methyl]-N-propan-2-ylaniline
CID 63059826
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'-[2-[(2-methoxyethylamino)methyl]phenyl]-N,N,N'-trimethylpropane-1,3-diamine
CID 63699734
N'-ethyl-N-(2-methoxyethyl)-N'-(2-methylphenyl)ethane-1,2-diamine
CID 62575841
N,N-diethyl-2-(methylaminomethyl)aniline
CID 43243693
N'-ethyl-N-(2-methoxyethyl)-N'-(2-methylphenyl)propane-1,3-diamine
CID 62569298
N-(3-methoxypropyl)-N-methyl-2-(propylaminomethyl)aniline
CID 55141079
N-[(2-fluorophenyl)methyl]-2-methoxyethanamine;hydrochloride
CID 17294446
N-[(2-ethylsulfanylphenyl)methyl]-2-methoxyethanamine
CID 63806580

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-[(2-methoxyethylamino)methyl]aniline?
The IUPAC name of N,N-diethyl-2-[(2-methoxyethylamino)methyl]aniline (CID 63058895) is N,N-diethyl-2-[(2-methoxyethylamino)methyl]aniline.
What is the SMILES notation for N,N-diethyl-2-[(2-methoxyethylamino)methyl]aniline?
The canonical SMILES for N,N-diethyl-2-[(2-methoxyethylamino)methyl]aniline is CCN(CC)c1ccccc1CNCCOC.
What is the InChIKey of N,N-diethyl-2-[(2-methoxyethylamino)methyl]aniline?
The InChIKey is PDGRQINCIMBVSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-4-16(5-2)14-9-7-6-8-13(14)12-15-10-11-17-3/h6-9,15H,4-5,10-12H2,1-3H3.
What are the key properties of N,N-diethyl-2-[(2-methoxyethylamino)methyl]aniline?
N,N-diethyl-2-[(2-methoxyethylamino)methyl]aniline has a molecular weight of 236.36 g/mol, XLogP of 2.27, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-[(2-methoxyethylamino)methyl]aniline is sourced from PubChem (CID 63058895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).