2-(4-bromophenyl)-1-(2-methylnaphthalen-1-yl)ethanamine

C19H18BrN — CID 81430292

IUPAC2-(4-bromophenyl)-1-(2-methylnaphthalen-1-yl)ethanamine
SMILESCc1ccc2ccccc2c1C(N)Cc1ccc(Br)cc1
InChIInChI=1S/C19H18BrN/c1-13-6-9-15-4-2-3-5-17(15)19(13)18(21)12-14-7-10-16(20)11-8-14/h2-11,18H,12,21H2,1H3
InChIKeyULLGALAGDSLBOF-UHFFFAOYSA-N
MW340.26 g/mol
LogP5.15
Rot. Bonds3

About 2-(4-bromophenyl)-1-(2-methylnaphthalen-1-yl)ethanamine

2-(4-bromophenyl)-1-(2-methylnaphthalen-1-yl)ethanamine (PubChem CID 81430292) has the molecular formula C19H18BrN and a molecular weight of 340.26 g/mol. Its IUPAC name is 2-(4-bromophenyl)-1-(2-methylnaphthalen-1-yl)ethanamine.

Molecular Properties

Compound Name2-(4-bromophenyl)-1-(2-methylnaphthalen-1-yl)ethanamine
PubChem CID81430292
Molecular FormulaC19H18BrN
Molecular Weight340.26 g/mol
Exact Mass339.06
IUPAC Name2-(4-bromophenyl)-1-(2-methylnaphthalen-1-yl)ethanamine
SMILESCc1ccc2ccccc2c1C(N)Cc1ccc(Br)cc1
InChIInChI=1S/C19H18BrN/c1-13-6-9-15-4-2-3-5-17(15)19(13)18(21)12-14-7-10-16(20)11-8-14/h2-11,18H,12,21H2,1H3
InChIKeyULLGALAGDSLBOF-UHFFFAOYSA-N
XLogP5.15
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500340.26
LogP ≤ 55.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-(4-bromophenyl)-1-(2-methylnaphthalen-1-yl)ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(S)-(4-bromophenyl)-(2-methylnaphthalen-1-yl)methanol
CID 99714820
2-(4-bromophenyl)-1-(4-fluoro-2,6-dimethylphenyl)ethanamine
CID 106877345
1-(2-methylnaphthalen-1-yl)-2-methylsulfonylethanamine
CID 81431572
1-(3-bromo-4-methylphenyl)-2-(4-bromophenyl)ethanamine
CID 81471892
1-(4-bromonaphthalen-1-yl)-2-(4-bromophenyl)ethanamine
CID 79589925
2-(4-bromophenyl)-1-(2-methylnaphthalen-1-yl)ethanone
CID 81430854
2-(4-bromophenyl)-1-(2-fluoro-3-methylphenyl)ethanamine
CID 81477646
1-[(R)-amino-(4-bromophenyl)methyl]naphthalen-2-ol
CID 39345448
ethane;2-methyl-1-propan-2-ylnaphthalene
CID 144871891
2-(4-bromophenyl)-1-(4-methylphenyl)ethanamine
CID 24697978
(4-bromophenyl)-(2-methylnaphthalen-1-yl)methanone
CID 81430357
2-(4-bromophenyl)-1-(5-chloro-2-methylphenyl)ethanamine
CID 82883536

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenyl)-1-(2-methylnaphthalen-1-yl)ethanamine?
The IUPAC name of 2-(4-bromophenyl)-1-(2-methylnaphthalen-1-yl)ethanamine (CID 81430292) is 2-(4-bromophenyl)-1-(2-methylnaphthalen-1-yl)ethanamine.
What is the SMILES notation for 2-(4-bromophenyl)-1-(2-methylnaphthalen-1-yl)ethanamine?
The canonical SMILES for 2-(4-bromophenyl)-1-(2-methylnaphthalen-1-yl)ethanamine is Cc1ccc2ccccc2c1C(N)Cc1ccc(Br)cc1.
What is the InChIKey of 2-(4-bromophenyl)-1-(2-methylnaphthalen-1-yl)ethanamine?
The InChIKey is ULLGALAGDSLBOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18BrN/c1-13-6-9-15-4-2-3-5-17(15)19(13)18(21)12-14-7-10-16(20)11-8-14/h2-11,18H,12,21H2,1H3.
What are the key properties of 2-(4-bromophenyl)-1-(2-methylnaphthalen-1-yl)ethanamine?
2-(4-bromophenyl)-1-(2-methylnaphthalen-1-yl)ethanamine has a molecular weight of 340.26 g/mol, XLogP of 5.15, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenyl)-1-(2-methylnaphthalen-1-yl)ethanamine is sourced from PubChem (CID 81430292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).