1-(5-bromo-2-fluorophenyl)-2-(4-chlorophenyl)propan-2-amine

C15H14BrClFN — CID 55186392

IUPAC1-(5-bromo-2-fluorophenyl)-2-(4-chlorophenyl)propan-2-amine
SMILESCC(N)(Cc1cc(Br)ccc1F)c1ccc(Cl)cc1
InChIInChI=1S/C15H14BrClFN/c1-15(19,11-2-5-13(17)6-3-11)9-10-8-12(16)4-7-14(10)18/h2-8H,9,19H2,1H3
InChIKeySCLYSHDYRVXJMA-UHFFFAOYSA-N
MW342.64 g/mol
LogP4.66
Rot. Bonds3

About 1-(5-bromo-2-fluorophenyl)-2-(4-chlorophenyl)propan-2-amine

1-(5-bromo-2-fluorophenyl)-2-(4-chlorophenyl)propan-2-amine (PubChem CID 55186392) has the molecular formula C15H14BrClFN and a molecular weight of 342.64 g/mol. Its IUPAC name is 1-(5-bromo-2-fluorophenyl)-2-(4-chlorophenyl)propan-2-amine.

Molecular Properties

Compound Name1-(5-bromo-2-fluorophenyl)-2-(4-chlorophenyl)propan-2-amine
PubChem CID55186392
Molecular FormulaC15H14BrClFN
Molecular Weight342.64 g/mol
Exact Mass341.00
IUPAC Name1-(5-bromo-2-fluorophenyl)-2-(4-chlorophenyl)propan-2-amine
SMILESCC(N)(Cc1cc(Br)ccc1F)c1ccc(Cl)cc1
InChIInChI=1S/C15H14BrClFN/c1-15(19,11-2-5-13(17)6-3-11)9-10-8-12(16)4-7-14(10)18/h2-8H,9,19H2,1H3
InChIKeySCLYSHDYRVXJMA-UHFFFAOYSA-N
XLogP4.66
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.64
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-(5-bromo-2-fluorophenyl)-2-(4-chlorophenyl)propan-2-amine 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-Chloro-2-fluorophenyl)cyclohexan-1-amine
CID 80199845
1-(2-Bromophenyl)-2-(2-chloro-6-fluorophenyl)ethan-1-amine
CID 54594869
3-(3-Bromo-5-fluorophenyl)-4-(4-chlorophenyl)butan-2-amine
CID 22270718
2-(4-Chloro-2-fluorophenyl)propan-2-amine
CID 56973673
1-[3-Azido-1-(4-chlorophenyl)butan-2-yl]-3-bromo-5-fluorobenzene
CID 57438718
(S)-2-(3-bromo-4-fluorophenyl)-4-methylpent-4-en-2-amine
CID 57948940
(2S)-3-(3-bromophenyl)-4-(4-chlorophenyl)-3-fluorobutan-2-amine
CID 59682348
2-(3-Bromo-4-fluorophenyl)-4-methylpent-4-en-2-amine
CID 67025274
(2R)-1-(3-bromo-4-fluorophenyl)-2-(4-chloro-3-methylphenyl)butan-1-amine
CID 67537218
2-(3-Bromo-2-fluorophenyl)propan-2-amine
CID 68327749
2-(5-Bromo-2-fluorophenyl)propan-2-amine
CID 68327802
2-(3-Bromo-4-fluorophenyl)propan-2-amine
CID 68327938

Frequently Asked Questions

What is the IUPAC name of 1-(5-bromo-2-fluorophenyl)-2-(4-chlorophenyl)propan-2-amine?
The IUPAC name of 1-(5-bromo-2-fluorophenyl)-2-(4-chlorophenyl)propan-2-amine (CID 55186392) is 1-(5-bromo-2-fluorophenyl)-2-(4-chlorophenyl)propan-2-amine.
What is the SMILES notation for 1-(5-bromo-2-fluorophenyl)-2-(4-chlorophenyl)propan-2-amine?
The canonical SMILES for 1-(5-bromo-2-fluorophenyl)-2-(4-chlorophenyl)propan-2-amine is CC(N)(Cc1cc(Br)ccc1F)c1ccc(Cl)cc1.
What is the InChIKey of 1-(5-bromo-2-fluorophenyl)-2-(4-chlorophenyl)propan-2-amine?
The InChIKey is SCLYSHDYRVXJMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14BrClFN/c1-15(19,11-2-5-13(17)6-3-11)9-10-8-12(16)4-7-14(10)18/h2-8H,9,19H2,1H3.
What are the key properties of 1-(5-bromo-2-fluorophenyl)-2-(4-chlorophenyl)propan-2-amine?
1-(5-bromo-2-fluorophenyl)-2-(4-chlorophenyl)propan-2-amine has a molecular weight of 342.64 g/mol, XLogP of 4.66, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-bromo-2-fluorophenyl)-2-(4-chlorophenyl)propan-2-amine is sourced from PubChem (CID 55186392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).