2-ethoxy-N-methyl-2-naphthalen-1-ylethanamine

C15H19NO — CID 53276223

IUPAC2-ethoxy-N-methyl-2-naphthalen-1-ylethanamine
SMILESCCOC(CNC)c1cccc2ccccc12
InChIInChI=1S/C15H19NO/c1-3-17-15(11-16-2)14-10-6-8-12-7-4-5-9-13(12)14/h4-10,15-16H,3,11H2,1-2H3
InChIKeyWZQHOWWJBVLFCD-UHFFFAOYSA-N
MW229.32 g/mol
LogP3.14
Rot. Bonds5

About 2-ethoxy-N-methyl-2-naphthalen-1-ylethanamine

2-ethoxy-N-methyl-2-naphthalen-1-ylethanamine (PubChem CID 53276223) has the molecular formula C15H19NO and a molecular weight of 229.32 g/mol. Its IUPAC name is 2-ethoxy-N-methyl-2-naphthalen-1-ylethanamine.

Molecular Properties

Compound Name2-ethoxy-N-methyl-2-naphthalen-1-ylethanamine
PubChem CID53276223
Molecular FormulaC15H19NO
Molecular Weight229.32 g/mol
Exact Mass229.15
IUPAC Name2-ethoxy-N-methyl-2-naphthalen-1-ylethanamine
SMILESCCOC(CNC)c1cccc2ccccc12
InChIInChI=1S/C15H19NO/c1-3-17-15(11-16-2)14-10-6-8-12-7-4-5-9-13(12)14/h4-10,15-16H,3,11H2,1-2H3
InChIKeyWZQHOWWJBVLFCD-UHFFFAOYSA-N
XLogP3.14
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-methyl-2-naphthalen-1-ylethanamine?
The IUPAC name of 2-ethoxy-N-methyl-2-naphthalen-1-ylethanamine (CID 53276223) is 2-ethoxy-N-methyl-2-naphthalen-1-ylethanamine.
What is the SMILES notation for 2-ethoxy-N-methyl-2-naphthalen-1-ylethanamine?
The canonical SMILES for 2-ethoxy-N-methyl-2-naphthalen-1-ylethanamine is CCOC(CNC)c1cccc2ccccc12.
What is the InChIKey of 2-ethoxy-N-methyl-2-naphthalen-1-ylethanamine?
The InChIKey is WZQHOWWJBVLFCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO/c1-3-17-15(11-16-2)14-10-6-8-12-7-4-5-9-13(12)14/h4-10,15-16H,3,11H2,1-2H3.
What are the key properties of 2-ethoxy-N-methyl-2-naphthalen-1-ylethanamine?
2-ethoxy-N-methyl-2-naphthalen-1-ylethanamine has a molecular weight of 229.32 g/mol, XLogP of 3.14, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-methyl-2-naphthalen-1-ylethanamine is sourced from PubChem (CID 53276223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).