(3-bromo-5-fluorophenyl)-(2,4-dimethoxyphenyl)methanamine

C15H15BrFNO2 — CID 43248329

IUPAC(3-bromo-5-fluorophenyl)-(2,4-dimethoxyphenyl)methanamine
SMILESCOc1ccc(C(N)c2cc(F)cc(Br)c2)c(OC)c1
InChIInChI=1S/C15H15BrFNO2/c1-19-12-3-4-13(14(8-12)20-2)15(18)9-5-10(16)7-11(17)6-9/h3-8,15H,18H2,1-2H3
InChIKeyUJEMVDDCQSCMSZ-UHFFFAOYSA-N
MW340.19 g/mol
LogP3.65
Rot. Bonds4

About (3-bromo-5-fluorophenyl)-(2,4-dimethoxyphenyl)methanamine

(3-bromo-5-fluorophenyl)-(2,4-dimethoxyphenyl)methanamine (PubChem CID 43248329) has the molecular formula C15H15BrFNO2 and a molecular weight of 340.19 g/mol. Its IUPAC name is (3-bromo-5-fluorophenyl)-(2,4-dimethoxyphenyl)methanamine.

Molecular Properties

Compound Name(3-bromo-5-fluorophenyl)-(2,4-dimethoxyphenyl)methanamine
PubChem CID43248329
Molecular FormulaC15H15BrFNO2
Molecular Weight340.19 g/mol
Exact Mass339.03
IUPAC Name(3-bromo-5-fluorophenyl)-(2,4-dimethoxyphenyl)methanamine
SMILESCOc1ccc(C(N)c2cc(F)cc(Br)c2)c(OC)c1
InChIInChI=1S/C15H15BrFNO2/c1-19-12-3-4-13(14(8-12)20-2)15(18)9-5-10(16)7-11(17)6-9/h3-8,15H,18H2,1-2H3
InChIKeyUJEMVDDCQSCMSZ-UHFFFAOYSA-N
XLogP3.65
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.19
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (3-bromo-5-fluorophenyl)-(2,4-dimethoxyphenyl)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

(2-bromo-5-fluorophenyl)-(2,4-dimethoxyphenyl)methanamine
CID 43197258
(2,4-dimethoxyphenyl)-(4-fluoro-2,6-dimethylphenyl)methanamine
CID 106877206
(3-bromo-4-methoxyphenyl)-(2,4-dimethoxyphenyl)methanamine
CID 43131080
(4-chloro-2-methoxyphenyl)-(3,5-difluorophenyl)methanamine
CID 115851745
(3-bromo-5-fluorophenyl)-(4-ethoxyphenyl)methanamine
CID 43248327
1-(3-bromo-5-fluorophenyl)-1-(2-fluoro-4-methoxyphenyl)-N-methylmethanamine
CID 43561405
(4-bromophenyl)-(2-fluoro-4-methoxyphenyl)methanamine
CID 43561243
(4-chloro-2-methoxyphenyl)-(3-fluoro-5-methylphenyl)methanamine
CID 105016596
1-(3-bromo-5-fluorophenyl)-2-(4-methoxyphenyl)ethanamine
CID 61079421
1-[1-(4-fluorophenyl)ethyl]-2,4-dimethoxybenzene
CID 132933151
(3-bromo-5-fluorophenyl)-(2,3,4-trifluorophenyl)methanamine
CID 66425066
(4-chloro-2-fluorophenyl)-(2,4-dimethoxyphenyl)methanamine
CID 43197289

Frequently Asked Questions

What is the IUPAC name of (3-bromo-5-fluorophenyl)-(2,4-dimethoxyphenyl)methanamine?
The IUPAC name of (3-bromo-5-fluorophenyl)-(2,4-dimethoxyphenyl)methanamine (CID 43248329) is (3-bromo-5-fluorophenyl)-(2,4-dimethoxyphenyl)methanamine.
What is the SMILES notation for (3-bromo-5-fluorophenyl)-(2,4-dimethoxyphenyl)methanamine?
The canonical SMILES for (3-bromo-5-fluorophenyl)-(2,4-dimethoxyphenyl)methanamine is COc1ccc(C(N)c2cc(F)cc(Br)c2)c(OC)c1.
What is the InChIKey of (3-bromo-5-fluorophenyl)-(2,4-dimethoxyphenyl)methanamine?
The InChIKey is UJEMVDDCQSCMSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrFNO2/c1-19-12-3-4-13(14(8-12)20-2)15(18)9-5-10(16)7-11(17)6-9/h3-8,15H,18H2,1-2H3.
What are the key properties of (3-bromo-5-fluorophenyl)-(2,4-dimethoxyphenyl)methanamine?
(3-bromo-5-fluorophenyl)-(2,4-dimethoxyphenyl)methanamine has a molecular weight of 340.19 g/mol, XLogP of 3.65, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-bromo-5-fluorophenyl)-(2,4-dimethoxyphenyl)methanamine is sourced from PubChem (CID 43248329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).