6-bromo-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride

C10H13BrClN — CID 53408375

IUPAC6-bromo-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride
SMILESCl.NC1CCc2cc(Br)ccc2C1
InChIInChI=1S/C10H12BrN.ClH/c11-9-3-1-8-6-10(12)4-2-7(8)5-9;/h1,3,5,10H,2,4,6,12H2;1H
InChIKeyFCAYWFRPXBBGGY-UHFFFAOYSA-N
MW262.58 g/mol
LogP2.69
Rot. Bonds

About 6-bromo-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride

6-bromo-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride (PubChem CID 53408375) has the molecular formula C10H13BrClN and a molecular weight of 262.58 g/mol. Its IUPAC name is 6-bromo-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride.

Molecular Properties

Compound Name6-bromo-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride
PubChem CID53408375
Molecular FormulaC10H13BrClN
Molecular Weight262.58 g/mol
Exact Mass260.99
IUPAC Name6-bromo-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride
SMILESCl.NC1CCc2cc(Br)ccc2C1
InChIInChI=1S/C10H12BrN.ClH/c11-9-3-1-8-6-10(12)4-2-7(8)5-9;/h1,3,5,10H,2,4,6,12H2;1H
InChIKeyFCAYWFRPXBBGGY-UHFFFAOYSA-N
XLogP2.69
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.58
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride?
The IUPAC name of 6-bromo-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride (CID 53408375) is 6-bromo-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride.
What is the SMILES notation for 6-bromo-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride?
The canonical SMILES for 6-bromo-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride is Cl.NC1CCc2cc(Br)ccc2C1.
What is the InChIKey of 6-bromo-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride?
The InChIKey is FCAYWFRPXBBGGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12BrN.ClH/c11-9-3-1-8-6-10(12)4-2-7(8)5-9;/h1,3,5,10H,2,4,6,12H2;1H.
What are the key properties of 6-bromo-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride?
6-bromo-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride has a molecular weight of 262.58 g/mol, XLogP of 2.69, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride is sourced from PubChem (CID 53408375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).