(1R)-1-(8-bromonaphthalen-2-yl)ethanamine

C12H12BrN — CID 130625970

IUPAC(1R)-1-(8-bromonaphthalen-2-yl)ethanamine
SMILESC[C@@H](N)c1ccc2cccc(Br)c2c1
InChIInChI=1S/C12H12BrN/c1-8(14)10-6-5-9-3-2-4-12(13)11(9)7-10/h2-8H,14H2,1H3/t8-/m1/s1
InChIKeyJMAMQRXOXVLVKU-MRVPVSSYSA-N
MW250.14 g/mol
LogP3.62
Rot. Bonds1

About (1R)-1-(8-bromonaphthalen-2-yl)ethanamine

(1R)-1-(8-bromonaphthalen-2-yl)ethanamine (PubChem CID 130625970) has the molecular formula C12H12BrN and a molecular weight of 250.14 g/mol. Its IUPAC name is (1R)-1-(8-bromonaphthalen-2-yl)ethanamine.

Molecular Properties

Compound Name(1R)-1-(8-bromonaphthalen-2-yl)ethanamine
PubChem CID130625970
Molecular FormulaC12H12BrN
Molecular Weight250.14 g/mol
Exact Mass249.02
IUPAC Name(1R)-1-(8-bromonaphthalen-2-yl)ethanamine
SMILESC[C@@H](N)c1ccc2cccc(Br)c2c1
InChIInChI=1S/C12H12BrN/c1-8(14)10-6-5-9-3-2-4-12(13)11(9)7-10/h2-8H,14H2,1H3/t8-/m1/s1
InChIKeyJMAMQRXOXVLVKU-MRVPVSSYSA-N
XLogP3.62
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.14
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-naphthalen-2-ylethanamine
CID 3857145
(1S)-1-(3-bromo-4-naphthalen-2-ylsulfanylphenyl)ethanamine
CID 63533938
1-(5-bromonaphthalen-2-yl)-2,2-dimethylbutan-1-amine
CID 139609907
(1S)-1-(4-bromophenyl)ethanamine;(1S)-1-naphthalen-1-ylethanamine
CID 22806370
1-bromonaphthalene;methanamine
CID 143041720
1-(3-bromo-4-methylphenyl)ethanamine
CID 70795886
1-(3-bromophenyl)ethanamine;ethane
CID 142874111
8-bromonaphthalene-2-thiol
CID 168807371
1-(3-bromo-4-iodophenyl)ethanamine
CID 126971704
4-[(1R)-1-aminoethyl]-2-bromophenol
CID 78938003
1-bromo-3,7-di(propan-2-yl)naphthalene
CID 172853176
(1S)-1-[4-(1-bromonaphthalen-2-yl)oxyphenyl]ethanamine
CID 63532585

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(8-bromonaphthalen-2-yl)ethanamine?
The IUPAC name of (1R)-1-(8-bromonaphthalen-2-yl)ethanamine (CID 130625970) is (1R)-1-(8-bromonaphthalen-2-yl)ethanamine.
What is the SMILES notation for (1R)-1-(8-bromonaphthalen-2-yl)ethanamine?
The canonical SMILES for (1R)-1-(8-bromonaphthalen-2-yl)ethanamine is C[C@@H](N)c1ccc2cccc(Br)c2c1.
What is the InChIKey of (1R)-1-(8-bromonaphthalen-2-yl)ethanamine?
The InChIKey is JMAMQRXOXVLVKU-MRVPVSSYSA-N. The full InChI is InChI=1S/C12H12BrN/c1-8(14)10-6-5-9-3-2-4-12(13)11(9)7-10/h2-8H,14H2,1H3/t8-/m1/s1.
What are the key properties of (1R)-1-(8-bromonaphthalen-2-yl)ethanamine?
(1R)-1-(8-bromonaphthalen-2-yl)ethanamine has a molecular weight of 250.14 g/mol, XLogP of 3.62, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(8-bromonaphthalen-2-yl)ethanamine is sourced from PubChem (CID 130625970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).