N-(2-ethoxyethyl)-N-methyl-2-[1-(methylamino)ethyl]aniline

C14H24N2O — CID 81055457

IUPACN-(2-ethoxyethyl)-N-methyl-2-[1-(methylamino)ethyl]aniline
SMILESCCOCCN(C)c1ccccc1C(C)NC
InChIInChI=1S/C14H24N2O/c1-5-17-11-10-16(4)14-9-7-6-8-13(14)12(2)15-3/h6-9,12,15H,5,10-11H2,1-4H3
InChIKeyQYDTUIDTAPVHDK-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.44
Rot. Bonds7

About N-(2-ethoxyethyl)-N-methyl-2-[1-(methylamino)ethyl]aniline

N-(2-ethoxyethyl)-N-methyl-2-[1-(methylamino)ethyl]aniline (PubChem CID 81055457) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is N-(2-ethoxyethyl)-N-methyl-2-[1-(methylamino)ethyl]aniline.

Molecular Properties

Compound NameN-(2-ethoxyethyl)-N-methyl-2-[1-(methylamino)ethyl]aniline
PubChem CID81055457
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC NameN-(2-ethoxyethyl)-N-methyl-2-[1-(methylamino)ethyl]aniline
SMILESCCOCCN(C)c1ccccc1C(C)NC
InChIInChI=1S/C14H24N2O/c1-5-17-11-10-16(4)14-9-7-6-8-13(14)12(2)15-3/h6-9,12,15H,5,10-11H2,1-4H3
InChIKeyQYDTUIDTAPVHDK-UHFFFAOYSA-N
XLogP2.44
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.44
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

4-[2-[1-(ethylamino)ethyl]-N-methylanilino]butan-2-ol
CID 113499650
N-ethyl-2-[1-(ethylamino)ethyl]-N-methylaniline
CID 43284520
(1R)-1-[2-[2-methoxyethyl(methyl)amino]phenyl]propan-1-ol
CID 103959855
N-butan-2-yl-N-ethyl-2-[1-(methylamino)ethyl]aniline
CID 43284716
N-(2-ethoxyethyl)-N-ethyl-3-fluoro-2-[1-(methylamino)ethyl]aniline
CID 63697732
1-[[N-methyl-2-[1-(methylamino)ethyl]anilino]methyl]cyclopentan-1-ol
CID 114949985
2-[(1R)-1-aminoethyl]-N-(2-ethoxyethyl)-N-ethylaniline
CID 63697735
(1R)-1-[2-[2-ethoxyethyl(ethyl)amino]phenyl]ethanol
CID 55226911
1-[2-[1-(ethylamino)ethyl]-N-methylanilino]-3-methoxypropan-2-ol
CID 54994046
3-N-(2-ethoxyethyl)-3-N,2-dimethylbenzene-1,3-diamine
CID 81059669
2-(1-aminoethyl)-N-methyl-N-(2-propan-2-yloxyethyl)aniline
CID 81055890
2-[3-ethoxypropyl(methyl)amino]phenol
CID 18006894

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyethyl)-N-methyl-2-[1-(methylamino)ethyl]aniline?
The IUPAC name of N-(2-ethoxyethyl)-N-methyl-2-[1-(methylamino)ethyl]aniline (CID 81055457) is N-(2-ethoxyethyl)-N-methyl-2-[1-(methylamino)ethyl]aniline.
What is the SMILES notation for N-(2-ethoxyethyl)-N-methyl-2-[1-(methylamino)ethyl]aniline?
The canonical SMILES for N-(2-ethoxyethyl)-N-methyl-2-[1-(methylamino)ethyl]aniline is CCOCCN(C)c1ccccc1C(C)NC.
What is the InChIKey of N-(2-ethoxyethyl)-N-methyl-2-[1-(methylamino)ethyl]aniline?
The InChIKey is QYDTUIDTAPVHDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-5-17-11-10-16(4)14-9-7-6-8-13(14)12(2)15-3/h6-9,12,15H,5,10-11H2,1-4H3.
What are the key properties of N-(2-ethoxyethyl)-N-methyl-2-[1-(methylamino)ethyl]aniline?
N-(2-ethoxyethyl)-N-methyl-2-[1-(methylamino)ethyl]aniline has a molecular weight of 236.36 g/mol, XLogP of 2.44, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyethyl)-N-methyl-2-[1-(methylamino)ethyl]aniline is sourced from PubChem (CID 81055457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).