(1R)-6-bromo-1,2,3,4-tetrahydronaphthalen-1-amine

C10H12BrN — CID 71416765

IUPAC(1R)-6-bromo-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESN[C@@H]1CCCc2cc(Br)ccc21
InChIInChI=1S/C10H12BrN/c11-8-4-5-9-7(6-8)2-1-3-10(9)12/h4-6,10H,1-3,12H2/t10-/m1/s1
InChIKeyJBGXAYOORBASGV-SNVBAGLBSA-N
MW226.12 g/mol
LogP2.79
Rot. Bonds

About (1R)-6-bromo-1,2,3,4-tetrahydronaphthalen-1-amine

(1R)-6-bromo-1,2,3,4-tetrahydronaphthalen-1-amine (PubChem CID 71416765) has the molecular formula C10H12BrN and a molecular weight of 226.12 g/mol. Its IUPAC name is (1R)-6-bromo-1,2,3,4-tetrahydronaphthalen-1-amine.

Molecular Properties

Compound Name(1R)-6-bromo-1,2,3,4-tetrahydronaphthalen-1-amine
PubChem CID71416765
Molecular FormulaC10H12BrN
Molecular Weight226.12 g/mol
Exact Mass225.02
IUPAC Name(1R)-6-bromo-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESN[C@@H]1CCCc2cc(Br)ccc21
InChIInChI=1S/C10H12BrN/c11-8-4-5-9-7(6-8)2-1-3-10(9)12/h4-6,10H,1-3,12H2/t10-/m1/s1
InChIKeyJBGXAYOORBASGV-SNVBAGLBSA-N
XLogP2.79
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.12
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (1R)-6-bromo-1,2,3,4-tetrahydronaphthalen-1-amine?
The IUPAC name of (1R)-6-bromo-1,2,3,4-tetrahydronaphthalen-1-amine (CID 71416765) is (1R)-6-bromo-1,2,3,4-tetrahydronaphthalen-1-amine.
What is the SMILES notation for (1R)-6-bromo-1,2,3,4-tetrahydronaphthalen-1-amine?
The canonical SMILES for (1R)-6-bromo-1,2,3,4-tetrahydronaphthalen-1-amine is N[C@@H]1CCCc2cc(Br)ccc21.
What is the InChIKey of (1R)-6-bromo-1,2,3,4-tetrahydronaphthalen-1-amine?
The InChIKey is JBGXAYOORBASGV-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H12BrN/c11-8-4-5-9-7(6-8)2-1-3-10(9)12/h4-6,10H,1-3,12H2/t10-/m1/s1.
What are the key properties of (1R)-6-bromo-1,2,3,4-tetrahydronaphthalen-1-amine?
(1R)-6-bromo-1,2,3,4-tetrahydronaphthalen-1-amine has a molecular weight of 226.12 g/mol, XLogP of 2.79, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-6-bromo-1,2,3,4-tetrahydronaphthalen-1-amine is sourced from PubChem (CID 71416765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).