[2-(ethoxymethyl)phenyl]methanamine

C10H15NO — CID 16792336

IUPAC[2-(ethoxymethyl)phenyl]methanamine
SMILESCCOCc1ccccc1CN
InChIInChI=1S/C10H15NO/c1-2-12-8-10-6-4-3-5-9(10)7-11/h3-6H,2,7-8,11H2,1H3
InChIKeyXRHPSGUGMIFVLP-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.68
Rot. Bonds4

About [2-(ethoxymethyl)phenyl]methanamine

[2-(ethoxymethyl)phenyl]methanamine (PubChem CID 16792336) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is [2-(ethoxymethyl)phenyl]methanamine.

Molecular Properties

Compound Name[2-(ethoxymethyl)phenyl]methanamine
PubChem CID16792336
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name[2-(ethoxymethyl)phenyl]methanamine
SMILESCCOCc1ccccc1CN
InChIInChI=1S/C10H15NO/c1-2-12-8-10-6-4-3-5-9(10)7-11/h3-6H,2,7-8,11H2,1H3
InChIKeyXRHPSGUGMIFVLP-UHFFFAOYSA-N
XLogP1.68
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [2-(ethoxymethyl)phenyl]methanamine?
The IUPAC name of [2-(ethoxymethyl)phenyl]methanamine (CID 16792336) is [2-(ethoxymethyl)phenyl]methanamine.
What is the SMILES notation for [2-(ethoxymethyl)phenyl]methanamine?
The canonical SMILES for [2-(ethoxymethyl)phenyl]methanamine is CCOCc1ccccc1CN.
What is the InChIKey of [2-(ethoxymethyl)phenyl]methanamine?
The InChIKey is XRHPSGUGMIFVLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c1-2-12-8-10-6-4-3-5-9(10)7-11/h3-6H,2,7-8,11H2,1H3.
What are the key properties of [2-(ethoxymethyl)phenyl]methanamine?
[2-(ethoxymethyl)phenyl]methanamine has a molecular weight of 165.24 g/mol, XLogP of 1.68, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(ethoxymethyl)phenyl]methanamine is sourced from PubChem (CID 16792336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).