N-[[2-(2-methoxyethoxy)phenyl]methyl]-2,4,6-trimethylaniline

C19H25NO2 — CID 39422606

IUPACN-[[2-(2-methoxyethoxy)phenyl]methyl]-2,4,6-trimethylaniline
SMILESCOCCOc1ccccc1CNc1c(C)cc(C)cc1C
InChIInChI=1S/C19H25NO2/c1-14-11-15(2)19(16(3)12-14)20-13-17-7-5-6-8-18(17)22-10-9-21-4/h5-8,11-12,20H,9-10,13H2,1-4H3
InChIKeyHZFONJDBJPJZAW-UHFFFAOYSA-N
MW299.41 g/mol
LogP4.25
Rot. Bonds7

About N-[[2-(2-methoxyethoxy)phenyl]methyl]-2,4,6-trimethylaniline

N-[[2-(2-methoxyethoxy)phenyl]methyl]-2,4,6-trimethylaniline (PubChem CID 39422606) has the molecular formula C19H25NO2 and a molecular weight of 299.41 g/mol. Its IUPAC name is N-[[2-(2-methoxyethoxy)phenyl]methyl]-2,4,6-trimethylaniline.

Molecular Properties

Compound NameN-[[2-(2-methoxyethoxy)phenyl]methyl]-2,4,6-trimethylaniline
PubChem CID39422606
Molecular FormulaC19H25NO2
Molecular Weight299.41 g/mol
Exact Mass299.19
IUPAC NameN-[[2-(2-methoxyethoxy)phenyl]methyl]-2,4,6-trimethylaniline
SMILESCOCCOc1ccccc1CNc1c(C)cc(C)cc1C
InChIInChI=1S/C19H25NO2/c1-14-11-15(2)19(16(3)12-14)20-13-17-7-5-6-8-18(17)22-10-9-21-4/h5-8,11-12,20H,9-10,13H2,1-4H3
InChIKeyHZFONJDBJPJZAW-UHFFFAOYSA-N
XLogP4.25
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.41
LogP ≤ 54.25
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

2,4,6-trimethyl-N-[[2-(2-phenylethoxy)phenyl]methyl]aniline
CID 54796664
2,4,6-trimethyl-N-[[2-(2-methylpropoxy)phenyl]methyl]aniline
CID 39418717
[2-(2-methoxyethoxy)phenyl]methylhydrazine
CID 105220831
4-tert-butyl-N-[[2-(2-methoxyethoxy)phenyl]methyl]aniline
CID 39455772
2-chloro-N-[[2-(2-methoxyethoxy)phenyl]methyl]aniline
CID 39399682
2-butoxy-N-[[2-(2-methoxyethoxy)phenyl]methyl]aniline
CID 54801593
3-fluoro-N-[[2-(2-methoxyethoxy)phenyl]methyl]aniline
CID 39374232
N-[[2-(2-methoxyethoxy)phenyl]methyl]naphthalen-1-amine
CID 54795963
N-[[2-(2-methoxyethoxy)phenyl]methyl]-5-methyl-1,3-thiazol-2-amine
CID 99783351
N-[[2-(2-methoxyethoxy)phenyl]methyl]-1-phenylmethanamine
CID 39370998
4-(2-methoxyethoxy)-N-[(2-propoxyphenyl)methyl]aniline
CID 54799789
N-[[2-(2-methoxyethoxy)phenyl]methyl]-2-methylpropan-1-amine
CID 61222098

Frequently Asked Questions

What is the IUPAC name of N-[[2-(2-methoxyethoxy)phenyl]methyl]-2,4,6-trimethylaniline?
The IUPAC name of N-[[2-(2-methoxyethoxy)phenyl]methyl]-2,4,6-trimethylaniline (CID 39422606) is N-[[2-(2-methoxyethoxy)phenyl]methyl]-2,4,6-trimethylaniline.
What is the SMILES notation for N-[[2-(2-methoxyethoxy)phenyl]methyl]-2,4,6-trimethylaniline?
The canonical SMILES for N-[[2-(2-methoxyethoxy)phenyl]methyl]-2,4,6-trimethylaniline is COCCOc1ccccc1CNc1c(C)cc(C)cc1C.
What is the InChIKey of N-[[2-(2-methoxyethoxy)phenyl]methyl]-2,4,6-trimethylaniline?
The InChIKey is HZFONJDBJPJZAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO2/c1-14-11-15(2)19(16(3)12-14)20-13-17-7-5-6-8-18(17)22-10-9-21-4/h5-8,11-12,20H,9-10,13H2,1-4H3.
What are the key properties of N-[[2-(2-methoxyethoxy)phenyl]methyl]-2,4,6-trimethylaniline?
N-[[2-(2-methoxyethoxy)phenyl]methyl]-2,4,6-trimethylaniline has a molecular weight of 299.41 g/mol, XLogP of 4.25, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(2-methoxyethoxy)phenyl]methyl]-2,4,6-trimethylaniline is sourced from PubChem (CID 39422606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).