4-[(4-methoxyphenyl)methoxy]-2,6-dimethylaniline

C16H19NO2 — CID 170076319

IUPAC4-[(4-methoxyphenyl)methoxy]-2,6-dimethylaniline
SMILESCOc1ccc(COc2cc(C)c(N)c(C)c2)cc1
InChIInChI=1S/C16H19NO2/c1-11-8-15(9-12(2)16(11)17)19-10-13-4-6-14(18-3)7-5-13/h4-9H,10,17H2,1-3H3
InChIKeyGRXBLQAJDRGFAX-UHFFFAOYSA-N
MW257.33 g/mol
LogP3.47
Rot. Bonds4

About 4-[(4-methoxyphenyl)methoxy]-2,6-dimethylaniline

4-[(4-methoxyphenyl)methoxy]-2,6-dimethylaniline (PubChem CID 170076319) has the molecular formula C16H19NO2 and a molecular weight of 257.33 g/mol. Its IUPAC name is 4-[(4-methoxyphenyl)methoxy]-2,6-dimethylaniline.

Molecular Properties

Compound Name4-[(4-methoxyphenyl)methoxy]-2,6-dimethylaniline
PubChem CID170076319
Molecular FormulaC16H19NO2
Molecular Weight257.33 g/mol
Exact Mass257.14
IUPAC Name4-[(4-methoxyphenyl)methoxy]-2,6-dimethylaniline
SMILESCOc1ccc(COc2cc(C)c(N)c(C)c2)cc1
InChIInChI=1S/C16H19NO2/c1-11-8-15(9-12(2)16(11)17)19-10-13-4-6-14(18-3)7-5-13/h4-9H,10,17H2,1-3H3
InChIKeyGRXBLQAJDRGFAX-UHFFFAOYSA-N
XLogP3.47
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-[(4-methoxyphenyl)methoxy]-2,6-dimethylbenzaldehyde
CID 89075943
4-[(3,5-dimethoxyphenoxy)methyl]aniline
CID 43589819
2-[(4-methoxyphenyl)methoxy]-6-methylaniline
CID 43381877
2-chloro-4-[(4-methoxyphenyl)methoxy]aniline
CID 62113615
4-[(4-chloro-3,5-dimethylphenoxy)methyl]aniline
CID 22688136
[4-[(4-methoxyphenyl)methoxy]-3-methylphenyl]methanamine
CID 54934427
2-bromo-4-[(4-methoxyphenyl)methoxy]-5-methylaniline
CID 137378485
1-methoxy-4-[(4-phenylmethoxyphenoxy)methyl]benzene
CID 12029541
2-bromo-4-[(4-methoxyphenoxy)methyl]-1-methylbenzene
CID 117221925
2-ethenyl-6-methyl-4-phenylmethoxyaniline
CID 143575474
4-[(4-iodophenyl)methoxy]-2-methylaniline
CID 65498774
1-[(4-iodophenyl)methoxy]-3,5-dimethoxybenzene
CID 65490326

Frequently Asked Questions

What is the IUPAC name of 4-[(4-methoxyphenyl)methoxy]-2,6-dimethylaniline?
The IUPAC name of 4-[(4-methoxyphenyl)methoxy]-2,6-dimethylaniline (CID 170076319) is 4-[(4-methoxyphenyl)methoxy]-2,6-dimethylaniline.
What is the SMILES notation for 4-[(4-methoxyphenyl)methoxy]-2,6-dimethylaniline?
The canonical SMILES for 4-[(4-methoxyphenyl)methoxy]-2,6-dimethylaniline is COc1ccc(COc2cc(C)c(N)c(C)c2)cc1.
What is the InChIKey of 4-[(4-methoxyphenyl)methoxy]-2,6-dimethylaniline?
The InChIKey is GRXBLQAJDRGFAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO2/c1-11-8-15(9-12(2)16(11)17)19-10-13-4-6-14(18-3)7-5-13/h4-9H,10,17H2,1-3H3.
What are the key properties of 4-[(4-methoxyphenyl)methoxy]-2,6-dimethylaniline?
4-[(4-methoxyphenyl)methoxy]-2,6-dimethylaniline has a molecular weight of 257.33 g/mol, XLogP of 3.47, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-methoxyphenyl)methoxy]-2,6-dimethylaniline is sourced from PubChem (CID 170076319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).