1-(2,4-dibromophenyl)-N-methyl-1-(4-propylphenyl)methanamine

C17H19Br2N — CID 107945722

IUPAC1-(2,4-dibromophenyl)-N-methyl-1-(4-propylphenyl)methanamine
SMILESCCCc1ccc(C(NC)c2ccc(Br)cc2Br)cc1
InChIInChI=1S/C17H19Br2N/c1-3-4-12-5-7-13(8-6-12)17(20-2)15-10-9-14(18)11-16(15)19/h5-11,17,20H,3-4H2,1-2H3
InChIKeyUGXSRMNHQFCACE-UHFFFAOYSA-N
MW397.15 g/mol
LogP5.47
Rot. Bonds5

About 1-(2,4-dibromophenyl)-N-methyl-1-(4-propylphenyl)methanamine

1-(2,4-dibromophenyl)-N-methyl-1-(4-propylphenyl)methanamine (PubChem CID 107945722) has the molecular formula C17H19Br2N and a molecular weight of 397.15 g/mol. Its IUPAC name is 1-(2,4-dibromophenyl)-N-methyl-1-(4-propylphenyl)methanamine.

Molecular Properties

Compound Name1-(2,4-dibromophenyl)-N-methyl-1-(4-propylphenyl)methanamine
PubChem CID107945722
Molecular FormulaC17H19Br2N
Molecular Weight397.15 g/mol
Exact Mass394.99
IUPAC Name1-(2,4-dibromophenyl)-N-methyl-1-(4-propylphenyl)methanamine
SMILESCCCc1ccc(C(NC)c2ccc(Br)cc2Br)cc1
InChIInChI=1S/C17H19Br2N/c1-3-4-12-5-7-13(8-6-12)17(20-2)15-10-9-14(18)11-16(15)19/h5-11,17,20H,3-4H2,1-2H3
InChIKeyUGXSRMNHQFCACE-UHFFFAOYSA-N
XLogP5.47
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500397.15
LogP ≤ 55.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-(2,4-dibromophenyl)-N-methyl-1-(4-propylphenyl)methanamine 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

1-(4-bromo-2-methylphenyl)-N-methyl-1-(4-propylphenyl)methanamine
CID 43629813
1-(5-bromo-2-fluorophenyl)-N-methyl-1-(4-propylphenyl)methanamine
CID 43484899
1-(4-bromo-2-chlorophenyl)-1-(4-butylphenyl)-N-methylmethanamine
CID 43805236
1-(3,5-dibromophenyl)-N-methyl-1-(4-propylphenyl)methanamine
CID 107975019
1-(2,4-dibromophenyl)-1-(4-fluorophenyl)-N-methylmethanamine
CID 107945033
1-(2-bromo-4-fluorophenyl)-1-(4-butylphenyl)-N-methylmethanamine
CID 43484374
1-(2,4-dibromophenyl)-1-(4-methoxyphenyl)-N-methylmethanamine
CID 107945123
N-[(2-bromo-4-chlorophenyl)-(4-propylphenyl)methyl]ethanamine
CID 107987414
[(4-bromo-2-fluorophenyl)-(4-propylphenyl)methyl]hydrazine
CID 105280828
1-(2-bromo-5-methylphenyl)-1-(4-butylphenyl)-N-methylmethanamine
CID 81110681
(2,5-dibromophenyl)-(4-propylphenyl)methanol
CID 114374739
1-(2-bromophenyl)-N-methyl-1-(3-propylphenyl)methanamine
CID 116544137

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dibromophenyl)-N-methyl-1-(4-propylphenyl)methanamine?
The IUPAC name of 1-(2,4-dibromophenyl)-N-methyl-1-(4-propylphenyl)methanamine (CID 107945722) is 1-(2,4-dibromophenyl)-N-methyl-1-(4-propylphenyl)methanamine.
What is the SMILES notation for 1-(2,4-dibromophenyl)-N-methyl-1-(4-propylphenyl)methanamine?
The canonical SMILES for 1-(2,4-dibromophenyl)-N-methyl-1-(4-propylphenyl)methanamine is CCCc1ccc(C(NC)c2ccc(Br)cc2Br)cc1.
What is the InChIKey of 1-(2,4-dibromophenyl)-N-methyl-1-(4-propylphenyl)methanamine?
The InChIKey is UGXSRMNHQFCACE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19Br2N/c1-3-4-12-5-7-13(8-6-12)17(20-2)15-10-9-14(18)11-16(15)19/h5-11,17,20H,3-4H2,1-2H3.
What are the key properties of 1-(2,4-dibromophenyl)-N-methyl-1-(4-propylphenyl)methanamine?
1-(2,4-dibromophenyl)-N-methyl-1-(4-propylphenyl)methanamine has a molecular weight of 397.15 g/mol, XLogP of 5.47, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dibromophenyl)-N-methyl-1-(4-propylphenyl)methanamine is sourced from PubChem (CID 107945722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).