N-[(2-ethylphenyl)methyl]-2-methoxyaniline

C16H19NO — CID 62391032

IUPACN-[(2-ethylphenyl)methyl]-2-methoxyaniline
SMILESCCc1ccccc1CNc1ccccc1OC
InChIInChI=1S/C16H19NO/c1-3-13-8-4-5-9-14(13)12-17-15-10-6-7-11-16(15)18-2/h4-11,17H,3,12H2,1-2H3
InChIKeyMSUQIHXFZVEDLR-UHFFFAOYSA-N
MW241.33 g/mol
LogP3.87
Rot. Bonds5

About N-[(2-ethylphenyl)methyl]-2-methoxyaniline

N-[(2-ethylphenyl)methyl]-2-methoxyaniline (PubChem CID 62391032) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is N-[(2-ethylphenyl)methyl]-2-methoxyaniline.

Molecular Properties

Compound NameN-[(2-ethylphenyl)methyl]-2-methoxyaniline
PubChem CID62391032
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC NameN-[(2-ethylphenyl)methyl]-2-methoxyaniline
SMILESCCc1ccccc1CNc1ccccc1OC
InChIInChI=1S/C16H19NO/c1-3-13-8-4-5-9-14(13)12-17-15-10-6-7-11-16(15)18-2/h4-11,17H,3,12H2,1-2H3
InChIKeyMSUQIHXFZVEDLR-UHFFFAOYSA-N
XLogP3.87
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethyl-N-[(2-ethylphenyl)methyl]aniline
CID 55197677
N-[(2-ethylphenyl)methyl]-2-(2-methylpropoxy)aniline
CID 63453225
N-[(3-ethoxy-2-methoxyphenyl)methyl]-2-methoxyaniline
CID 43757786
N-[(2-ethylphenyl)methyl]-2-methoxy-4-nitroaniline
CID 62391071
N-[(2-ethylphenyl)methyl]-2-methoxy-5-nitroaniline
CID 62391579
2-[2-[(2-methoxyphenyl)methylamino]phenyl]acetamide
CID 43738441
3-(2,6-diethylanilino)-N-(2-methoxyphenyl)propanamide
CID 109037115
N'-(2-ethyl-6-methylphenyl)-N-(2-methoxyphenyl)ethane-1,2-diamine
CID 54810086
2-ethoxy-N-[(2-methoxy-5-methylphenyl)methyl]aniline
CID 43408609
2-(2-hydroxyphenyl)-N-(2-methoxyphenyl)acetamide
CID 60615730
5-fluoro-2-methoxy-N-[(2-methoxyphenyl)methyl]aniline
CID 82539043
ethyl 2-[(2-hydroxy-3-methoxyphenyl)methylamino]benzoate
CID 51047332

Frequently Asked Questions

What is the IUPAC name of N-[(2-ethylphenyl)methyl]-2-methoxyaniline?
The IUPAC name of N-[(2-ethylphenyl)methyl]-2-methoxyaniline (CID 62391032) is N-[(2-ethylphenyl)methyl]-2-methoxyaniline.
What is the SMILES notation for N-[(2-ethylphenyl)methyl]-2-methoxyaniline?
The canonical SMILES for N-[(2-ethylphenyl)methyl]-2-methoxyaniline is CCc1ccccc1CNc1ccccc1OC.
What is the InChIKey of N-[(2-ethylphenyl)methyl]-2-methoxyaniline?
The InChIKey is MSUQIHXFZVEDLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO/c1-3-13-8-4-5-9-14(13)12-17-15-10-6-7-11-16(15)18-2/h4-11,17H,3,12H2,1-2H3.
What are the key properties of N-[(2-ethylphenyl)methyl]-2-methoxyaniline?
N-[(2-ethylphenyl)methyl]-2-methoxyaniline has a molecular weight of 241.33 g/mol, XLogP of 3.87, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-ethylphenyl)methyl]-2-methoxyaniline is sourced from PubChem (CID 62391032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).