5-methoxy-N,8-dimethyl-1,2,3,4-tetrahydronaphthalen-2-amine

C13H19NO — CID 22082782

IUPAC5-methoxy-N,8-dimethyl-1,2,3,4-tetrahydronaphthalen-2-amine
SMILESCNC1CCc2c(OC)ccc(C)c2C1
InChIInChI=1S/C13H19NO/c1-9-4-7-13(15-3)11-6-5-10(14-2)8-12(9)11/h4,7,10,14H,5-6,8H2,1-3H3
InChIKeyQBNVFXCJRLFRAF-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.08
Rot. Bonds2

About 5-methoxy-N,8-dimethyl-1,2,3,4-tetrahydronaphthalen-2-amine

5-methoxy-N,8-dimethyl-1,2,3,4-tetrahydronaphthalen-2-amine (PubChem CID 22082782) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 5-methoxy-N,8-dimethyl-1,2,3,4-tetrahydronaphthalen-2-amine.

Molecular Properties

Compound Name5-methoxy-N,8-dimethyl-1,2,3,4-tetrahydronaphthalen-2-amine
PubChem CID22082782
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name5-methoxy-N,8-dimethyl-1,2,3,4-tetrahydronaphthalen-2-amine
SMILESCNC1CCc2c(OC)ccc(C)c2C1
InChIInChI=1S/C13H19NO/c1-9-4-7-13(15-3)11-6-5-10(14-2)8-12(9)11/h4,7,10,14H,5-6,8H2,1-3H3
InChIKeyQBNVFXCJRLFRAF-UHFFFAOYSA-N
XLogP2.08
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-N,8-dimethyl-1,2,3,4-tetrahydronaphthalen-2-amine?
The IUPAC name of 5-methoxy-N,8-dimethyl-1,2,3,4-tetrahydronaphthalen-2-amine (CID 22082782) is 5-methoxy-N,8-dimethyl-1,2,3,4-tetrahydronaphthalen-2-amine.
What is the SMILES notation for 5-methoxy-N,8-dimethyl-1,2,3,4-tetrahydronaphthalen-2-amine?
The canonical SMILES for 5-methoxy-N,8-dimethyl-1,2,3,4-tetrahydronaphthalen-2-amine is CNC1CCc2c(OC)ccc(C)c2C1.
What is the InChIKey of 5-methoxy-N,8-dimethyl-1,2,3,4-tetrahydronaphthalen-2-amine?
The InChIKey is QBNVFXCJRLFRAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-9-4-7-13(15-3)11-6-5-10(14-2)8-12(9)11/h4,7,10,14H,5-6,8H2,1-3H3.
What are the key properties of 5-methoxy-N,8-dimethyl-1,2,3,4-tetrahydronaphthalen-2-amine?
5-methoxy-N,8-dimethyl-1,2,3,4-tetrahydronaphthalen-2-amine has a molecular weight of 205.30 g/mol, XLogP of 2.08, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-N,8-dimethyl-1,2,3,4-tetrahydronaphthalen-2-amine is sourced from PubChem (CID 22082782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).