1-(8-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-N-methylmethanamine

C13H19NO — CID 105458034

IUPAC1-(8-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-N-methylmethanamine
SMILESCNCC1CCCc2cccc(OC)c21
InChIInChI=1S/C13H19NO/c1-14-9-11-7-3-5-10-6-4-8-12(15-2)13(10)11/h4,6,8,11,14H,3,5,7,9H2,1-2H3
InChIKeyMMFFUKQWYPASTR-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.33
Rot. Bonds3

About 1-(8-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-N-methylmethanamine

1-(8-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-N-methylmethanamine (PubChem CID 105458034) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 1-(8-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(8-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-N-methylmethanamine
PubChem CID105458034
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name1-(8-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-N-methylmethanamine
SMILESCNCC1CCCc2cccc(OC)c21
InChIInChI=1S/C13H19NO/c1-14-9-11-7-3-5-10-6-4-8-12(15-2)13(10)11/h4,6,8,11,14H,3,5,7,9H2,1-2H3
InChIKeyMMFFUKQWYPASTR-UHFFFAOYSA-N
XLogP2.33
TPSA21.26 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 ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(8-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-N-methylmethanamine?
The IUPAC name of 1-(8-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-N-methylmethanamine (CID 105458034) is 1-(8-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(8-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-N-methylmethanamine?
The canonical SMILES for 1-(8-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-N-methylmethanamine is CNCC1CCCc2cccc(OC)c21.
What is the InChIKey of 1-(8-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-N-methylmethanamine?
The InChIKey is MMFFUKQWYPASTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-14-9-11-7-3-5-10-6-4-8-12(15-2)13(10)11/h4,6,8,11,14H,3,5,7,9H2,1-2H3.
What are the key properties of 1-(8-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-N-methylmethanamine?
1-(8-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-N-methylmethanamine has a molecular weight of 205.30 g/mol, XLogP of 2.33, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(8-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-N-methylmethanamine is sourced from PubChem (CID 105458034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).