1-(2-methoxyphenyl)-N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine

C19H23NO — CID 43480670

IUPAC1-(2-methoxyphenyl)-N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine
SMILESCNC(c1ccc2c(c1)CCCC2)c1ccccc1OC
InChIInChI=1S/C19H23NO/c1-20-19(17-9-5-6-10-18(17)21-2)16-12-11-14-7-3-4-8-15(14)13-16/h5-6,9-13,19-20H,3-4,7-8H2,1-2H3
InChIKeyGVELVZWLOZZQDG-UHFFFAOYSA-N
MW281.40 g/mol
LogP3.88
Rot. Bonds4

About 1-(2-methoxyphenyl)-N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine

1-(2-methoxyphenyl)-N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine (PubChem CID 43480670) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine.

Molecular Properties

Compound Name1-(2-methoxyphenyl)-N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine
PubChem CID43480670
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC Name1-(2-methoxyphenyl)-N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine
SMILESCNC(c1ccc2c(c1)CCCC2)c1ccccc1OC
InChIInChI=1S/C19H23NO/c1-20-19(17-9-5-6-10-18(17)21-2)16-12-11-14-7-3-4-8-15(14)13-16/h5-6,9-13,19-20H,3-4,7-8H2,1-2H3
InChIKeyGVELVZWLOZZQDG-UHFFFAOYSA-N
XLogP3.88
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenyl)-N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine?
The IUPAC name of 1-(2-methoxyphenyl)-N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine (CID 43480670) is 1-(2-methoxyphenyl)-N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine.
What is the SMILES notation for 1-(2-methoxyphenyl)-N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine?
The canonical SMILES for 1-(2-methoxyphenyl)-N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine is CNC(c1ccc2c(c1)CCCC2)c1ccccc1OC.
What is the InChIKey of 1-(2-methoxyphenyl)-N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine?
The InChIKey is GVELVZWLOZZQDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c1-20-19(17-9-5-6-10-18(17)21-2)16-12-11-14-7-3-4-8-15(14)13-16/h5-6,9-13,19-20H,3-4,7-8H2,1-2H3.
What are the key properties of 1-(2-methoxyphenyl)-N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine?
1-(2-methoxyphenyl)-N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine has a molecular weight of 281.40 g/mol, XLogP of 3.88, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)-N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine is sourced from PubChem (CID 43480670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).