2-(4-bromophenyl)-N-methyl-1-[4-(2-methylpropyl)phenyl]ethanamine

C19H24BrN — CID 43480571

IUPAC2-(4-bromophenyl)-N-methyl-1-[4-(2-methylpropyl)phenyl]ethanamine
SMILESCNC(Cc1ccc(Br)cc1)c1ccc(CC(C)C)cc1
InChIInChI=1S/C19H24BrN/c1-14(2)12-15-4-8-17(9-5-15)19(21-3)13-16-6-10-18(20)11-7-16/h4-11,14,19,21H,12-13H2,1-3H3
InChIKeyAJIPLEDCSLNRBY-UHFFFAOYSA-N
MW346.31 g/mol
LogP5.15
Rot. Bonds6

About 2-(4-bromophenyl)-N-methyl-1-[4-(2-methylpropyl)phenyl]ethanamine

2-(4-bromophenyl)-N-methyl-1-[4-(2-methylpropyl)phenyl]ethanamine (PubChem CID 43480571) has the molecular formula C19H24BrN and a molecular weight of 346.31 g/mol. Its IUPAC name is 2-(4-bromophenyl)-N-methyl-1-[4-(2-methylpropyl)phenyl]ethanamine.

Molecular Properties

Compound Name2-(4-bromophenyl)-N-methyl-1-[4-(2-methylpropyl)phenyl]ethanamine
PubChem CID43480571
Molecular FormulaC19H24BrN
Molecular Weight346.31 g/mol
Exact Mass345.11
IUPAC Name2-(4-bromophenyl)-N-methyl-1-[4-(2-methylpropyl)phenyl]ethanamine
SMILESCNC(Cc1ccc(Br)cc1)c1ccc(CC(C)C)cc1
InChIInChI=1S/C19H24BrN/c1-14(2)12-15-4-8-17(9-5-15)19(21-3)13-16-6-10-18(20)11-7-16/h4-11,14,19,21H,12-13H2,1-3H3
InChIKeyAJIPLEDCSLNRBY-UHFFFAOYSA-N
XLogP5.15
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500346.31
LogP ≤ 55.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-(4-bromophenyl)-N-methyl-1-[4-(2-methylpropyl)phenyl]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

2-(4-bromophenyl)-1-(4-iodophenyl)-N-methylethanamine
CID 63526519
2-(4-bromophenyl)-1-(3,5-dimethylphenyl)-N-methylethanamine
CID 63413113
1-(3,5-dibromophenyl)-N-methyl-2-(4-propan-2-ylphenyl)ethanamine
CID 107974526
3,3,3-trifluoro-N-methyl-1-[4-(2-methylpropyl)phenyl]propan-1-amine
CID 43480587
1-(3-bromo-4-methoxyphenyl)-2-(4-bromophenyl)-N-methylethanamine
CID 43479969
1,2-bis(4-bromophenyl)ethylhydrazine
CID 105192515
2-(4-bromophenyl)-N-methyl-1-(3-propan-2-yloxyphenyl)ethanamine
CID 63527212
2-(4-bromophenyl)-1-(3-methoxy-4-methylphenyl)-N-methylethanamine
CID 61065671
2-(4-bromophenyl)-1-(4-fluoro-3-methoxyphenyl)-N-methylethanamine
CID 81284038
N-methyl-1-[4-(2-methylpropyl)phenyl]-3-phenylpropan-1-amine
CID 43480559
1-(2,5-dibromophenyl)-N-methyl-2-(4-propan-2-ylphenyl)ethanamine
CID 115844386
2-(4-bromophenyl)-1-(3-methoxyphenyl)-N-methylethanamine
CID 60799436

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenyl)-N-methyl-1-[4-(2-methylpropyl)phenyl]ethanamine?
The IUPAC name of 2-(4-bromophenyl)-N-methyl-1-[4-(2-methylpropyl)phenyl]ethanamine (CID 43480571) is 2-(4-bromophenyl)-N-methyl-1-[4-(2-methylpropyl)phenyl]ethanamine.
What is the SMILES notation for 2-(4-bromophenyl)-N-methyl-1-[4-(2-methylpropyl)phenyl]ethanamine?
The canonical SMILES for 2-(4-bromophenyl)-N-methyl-1-[4-(2-methylpropyl)phenyl]ethanamine is CNC(Cc1ccc(Br)cc1)c1ccc(CC(C)C)cc1.
What is the InChIKey of 2-(4-bromophenyl)-N-methyl-1-[4-(2-methylpropyl)phenyl]ethanamine?
The InChIKey is AJIPLEDCSLNRBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24BrN/c1-14(2)12-15-4-8-17(9-5-15)19(21-3)13-16-6-10-18(20)11-7-16/h4-11,14,19,21H,12-13H2,1-3H3.
What are the key properties of 2-(4-bromophenyl)-N-methyl-1-[4-(2-methylpropyl)phenyl]ethanamine?
2-(4-bromophenyl)-N-methyl-1-[4-(2-methylpropyl)phenyl]ethanamine has a molecular weight of 346.31 g/mol, XLogP of 5.15, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenyl)-N-methyl-1-[4-(2-methylpropyl)phenyl]ethanamine is sourced from PubChem (CID 43480571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).