(1R)-6-bromo-8-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine

C11H14BrNO — CID 131146254

IUPAC(1R)-6-bromo-8-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCOc1cc(Br)cc2c1[C@H](N)CCC2
InChIInChI=1S/C11H14BrNO/c1-14-10-6-8(12)5-7-3-2-4-9(13)11(7)10/h5-6,9H,2-4,13H2,1H3/t9-/m1/s1
InChIKeyWYTUCSCWCRTGAZ-SECBINFHSA-N
MW256.14 g/mol
LogP2.79
Rot. Bonds1

About (1R)-6-bromo-8-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine

(1R)-6-bromo-8-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine (PubChem CID 131146254) has the molecular formula C11H14BrNO and a molecular weight of 256.14 g/mol. Its IUPAC name is (1R)-6-bromo-8-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine.

Molecular Properties

Compound Name(1R)-6-bromo-8-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
PubChem CID131146254
Molecular FormulaC11H14BrNO
Molecular Weight256.14 g/mol
Exact Mass255.03
IUPAC Name(1R)-6-bromo-8-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCOc1cc(Br)cc2c1[C@H](N)CCC2
InChIInChI=1S/C11H14BrNO/c1-14-10-6-8(12)5-7-3-2-4-9(13)11(7)10/h5-6,9H,2-4,13H2,1H3/t9-/m1/s1
InChIKeyWYTUCSCWCRTGAZ-SECBINFHSA-N
XLogP2.79
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.14
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

7-methoxy-5-methyl-2,3-dihydro-1H-inden-1-amine
CID 68632948
(1R)-7-methoxy-5-methyl-2,3-dihydro-1H-inden-1-amine
CID 130713773
(1S)-7-bromo-5,8-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 105057486
(1R)-8-iodo-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 131111271
5-bromo-1,3-dimethoxy-2-(3-methylcyclohex-2-en-1-yl)benzene
CID 155332959
8-bromo-1,2,3,4-tetrahydronaphthalene-1,6-diamine
CID 130044107
6-fluoro-7-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 22000970
(1R)-6-chloro-7-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 130707024
(1R)-6-bromo-1,2,3,4-tetrahydronaphthalen-1-amine
CID 71416765
(1R)-5-fluoro-7,8-dimethoxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 79014418
(1R)-6-chloro-8-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 130624873
6,8-difluoro-1,2,3,4-tetrahydronaphthalen-1-amine
CID 55253125

Frequently Asked Questions

What is the IUPAC name of (1R)-6-bromo-8-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine?
The IUPAC name of (1R)-6-bromo-8-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine (CID 131146254) is (1R)-6-bromo-8-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine.
What is the SMILES notation for (1R)-6-bromo-8-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine?
The canonical SMILES for (1R)-6-bromo-8-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine is COc1cc(Br)cc2c1[C@H](N)CCC2.
What is the InChIKey of (1R)-6-bromo-8-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine?
The InChIKey is WYTUCSCWCRTGAZ-SECBINFHSA-N. The full InChI is InChI=1S/C11H14BrNO/c1-14-10-6-8(12)5-7-3-2-4-9(13)11(7)10/h5-6,9H,2-4,13H2,1H3/t9-/m1/s1.
What are the key properties of (1R)-6-bromo-8-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine?
(1R)-6-bromo-8-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine has a molecular weight of 256.14 g/mol, XLogP of 2.79, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-6-bromo-8-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine is sourced from PubChem (CID 131146254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).