(2-ethoxyphenyl)-(2-ethylphenyl)methanamine

C17H21NO — CID 115853715

IUPAC(2-ethoxyphenyl)-(2-ethylphenyl)methanamine
SMILESCCOc1ccccc1C(N)c1ccccc1CC
InChIInChI=1S/C17H21NO/c1-3-13-9-5-6-10-14(13)17(18)15-11-7-8-12-16(15)19-4-2/h5-12,17H,3-4,18H2,1-2H3
InChIKeyWPXUAIWRICRFBQ-UHFFFAOYSA-N
MW255.36 g/mol
LogP3.70
Rot. Bonds5

About (2-ethoxyphenyl)-(2-ethylphenyl)methanamine

(2-ethoxyphenyl)-(2-ethylphenyl)methanamine (PubChem CID 115853715) has the molecular formula C17H21NO and a molecular weight of 255.36 g/mol. Its IUPAC name is (2-ethoxyphenyl)-(2-ethylphenyl)methanamine.

Molecular Properties

Compound Name(2-ethoxyphenyl)-(2-ethylphenyl)methanamine
PubChem CID115853715
Molecular FormulaC17H21NO
Molecular Weight255.36 g/mol
Exact Mass255.16
IUPAC Name(2-ethoxyphenyl)-(2-ethylphenyl)methanamine
SMILESCCOc1ccccc1C(N)c1ccccc1CC
InChIInChI=1S/C17H21NO/c1-3-13-9-5-6-10-14(13)17(18)15-11-7-8-12-16(15)19-4-2/h5-12,17H,3-4,18H2,1-2H3
InChIKeyWPXUAIWRICRFBQ-UHFFFAOYSA-N
XLogP3.70
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2-ethoxyphenyl)-(2-ethylphenyl)methanamine?
The IUPAC name of (2-ethoxyphenyl)-(2-ethylphenyl)methanamine (CID 115853715) is (2-ethoxyphenyl)-(2-ethylphenyl)methanamine.
What is the SMILES notation for (2-ethoxyphenyl)-(2-ethylphenyl)methanamine?
The canonical SMILES for (2-ethoxyphenyl)-(2-ethylphenyl)methanamine is CCOc1ccccc1C(N)c1ccccc1CC.
What is the InChIKey of (2-ethoxyphenyl)-(2-ethylphenyl)methanamine?
The InChIKey is WPXUAIWRICRFBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO/c1-3-13-9-5-6-10-14(13)17(18)15-11-7-8-12-16(15)19-4-2/h5-12,17H,3-4,18H2,1-2H3.
What are the key properties of (2-ethoxyphenyl)-(2-ethylphenyl)methanamine?
(2-ethoxyphenyl)-(2-ethylphenyl)methanamine has a molecular weight of 255.36 g/mol, XLogP of 3.70, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethoxyphenyl)-(2-ethylphenyl)methanamine is sourced from PubChem (CID 115853715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).