2-methoxy-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine

C13H19NO — CID 82283128

IUPAC2-methoxy-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine
SMILESCOCC(N)c1ccc2c(c1)CCCC2
InChIInChI=1S/C13H19NO/c1-15-9-13(14)12-7-6-10-4-2-3-5-11(10)8-12/h6-8,13H,2-5,9,14H2,1H3
InChIKeyHGGKIJBJFUDHIG-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.21
Rot. Bonds3

About 2-methoxy-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine

2-methoxy-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine (PubChem CID 82283128) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 2-methoxy-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine.

Molecular Properties

Compound Name2-methoxy-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine
PubChem CID82283128
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name2-methoxy-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine
SMILESCOCC(N)c1ccc2c(c1)CCCC2
InChIInChI=1S/C13H19NO/c1-15-9-13(14)12-7-6-10-4-2-3-5-11(10)8-12/h6-8,13H,2-5,9,14H2,1H3
InChIKeyHGGKIJBJFUDHIG-UHFFFAOYSA-N
XLogP2.21
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine?
The IUPAC name of 2-methoxy-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine (CID 82283128) is 2-methoxy-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine.
What is the SMILES notation for 2-methoxy-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine?
The canonical SMILES for 2-methoxy-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine is COCC(N)c1ccc2c(c1)CCCC2.
What is the InChIKey of 2-methoxy-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine?
The InChIKey is HGGKIJBJFUDHIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-15-9-13(14)12-7-6-10-4-2-3-5-11(10)8-12/h6-8,13H,2-5,9,14H2,1H3.
What are the key properties of 2-methoxy-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine?
2-methoxy-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine has a molecular weight of 205.30 g/mol, XLogP of 2.21, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine is sourced from PubChem (CID 82283128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).