2-(2-ethoxyphenyl)-5-methylaniline

C15H17NO — CID 82766449

IUPAC2-(2-ethoxyphenyl)-5-methylaniline
SMILESCCOc1ccccc1-c1ccc(C)cc1N
InChIInChI=1S/C15H17NO/c1-3-17-15-7-5-4-6-13(15)12-9-8-11(2)10-14(12)16/h4-10H,3,16H2,1-2H3
InChIKeyKQWGHVYYMRGYPX-UHFFFAOYSA-N
MW227.31 g/mol
LogP3.64
Rot. Bonds3

About 2-(2-ethoxyphenyl)-5-methylaniline

2-(2-ethoxyphenyl)-5-methylaniline (PubChem CID 82766449) has the molecular formula C15H17NO and a molecular weight of 227.31 g/mol. Its IUPAC name is 2-(2-ethoxyphenyl)-5-methylaniline.

Molecular Properties

Compound Name2-(2-ethoxyphenyl)-5-methylaniline
PubChem CID82766449
Molecular FormulaC15H17NO
Molecular Weight227.31 g/mol
Exact Mass227.13
IUPAC Name2-(2-ethoxyphenyl)-5-methylaniline
SMILESCCOc1ccccc1-c1ccc(C)cc1N
InChIInChI=1S/C15H17NO/c1-3-17-15-7-5-4-6-13(15)12-9-8-11(2)10-14(12)16/h4-10H,3,16H2,1-2H3
InChIKeyKQWGHVYYMRGYPX-UHFFFAOYSA-N
XLogP3.64
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(2-ethoxyphenyl)-5-methylbenzaldehyde
CID 172649130
2-(2-ethoxyphenoxy)-4-methylaniline
CID 26189556
2-amino-6-(2,4-dimethylphenyl)-4-(2-ethoxyphenyl)pyridine-3-carbonitrile
CID 3464758
6-(2-ethoxyphenyl)-2-methylpyridin-3-amine
CID 82467687
6-(2-aminophenyl)-2,3-diethoxyaniline
CID 175397921
2-ethoxyaniline;molecular hydrogen
CID 144877970
methyl 5-amino-2-(2-ethoxyphenyl)benzoate
CID 168665379
2-(5-ethoxy-3-pyridinyl)-5-methylaniline
CID 82766535
2-(2-ethoxyphenoxy)-5-methylbenzenecarbothioamide
CID 107929491
ethyl 3-amino-5-(2-ethoxyphenyl)-1H-pyrrole-2-carboxylate
CID 92715293
2-ethenyl-1-ethoxy-3-(2-ethoxyphenyl)benzene
CID 69455028
[2-(2-ethoxyphenyl)-4,5-dimethoxyphenyl]methanamine
CID 62800398

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethoxyphenyl)-5-methylaniline?
The IUPAC name of 2-(2-ethoxyphenyl)-5-methylaniline (CID 82766449) is 2-(2-ethoxyphenyl)-5-methylaniline.
What is the SMILES notation for 2-(2-ethoxyphenyl)-5-methylaniline?
The canonical SMILES for 2-(2-ethoxyphenyl)-5-methylaniline is CCOc1ccccc1-c1ccc(C)cc1N.
What is the InChIKey of 2-(2-ethoxyphenyl)-5-methylaniline?
The InChIKey is KQWGHVYYMRGYPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO/c1-3-17-15-7-5-4-6-13(15)12-9-8-11(2)10-14(12)16/h4-10H,3,16H2,1-2H3.
What are the key properties of 2-(2-ethoxyphenyl)-5-methylaniline?
2-(2-ethoxyphenyl)-5-methylaniline has a molecular weight of 227.31 g/mol, XLogP of 3.64, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxyphenyl)-5-methylaniline is sourced from PubChem (CID 82766449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).