1-(3,5-dibromophenyl)-1-(2-fluorophenyl)-N-methylmethanamine

C14H12Br2FN — CID 114022874

IUPAC1-(3,5-dibromophenyl)-1-(2-fluorophenyl)-N-methylmethanamine
SMILESCNC(c1cc(Br)cc(Br)c1)c1ccccc1F
InChIInChI=1S/C14H12Br2FN/c1-18-14(12-4-2-3-5-13(12)17)9-6-10(15)8-11(16)7-9/h2-8,14,18H,1H3
InChIKeyWTYSVECTNJCXKV-UHFFFAOYSA-N
MW373.06 g/mol
LogP4.66
Rot. Bonds3

About 1-(3,5-dibromophenyl)-1-(2-fluorophenyl)-N-methylmethanamine

1-(3,5-dibromophenyl)-1-(2-fluorophenyl)-N-methylmethanamine (PubChem CID 114022874) has the molecular formula C14H12Br2FN and a molecular weight of 373.06 g/mol. Its IUPAC name is 1-(3,5-dibromophenyl)-1-(2-fluorophenyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(3,5-dibromophenyl)-1-(2-fluorophenyl)-N-methylmethanamine
PubChem CID114022874
Molecular FormulaC14H12Br2FN
Molecular Weight373.06 g/mol
Exact Mass370.93
IUPAC Name1-(3,5-dibromophenyl)-1-(2-fluorophenyl)-N-methylmethanamine
SMILESCNC(c1cc(Br)cc(Br)c1)c1ccccc1F
InChIInChI=1S/C14H12Br2FN/c1-18-14(12-4-2-3-5-13(12)17)9-6-10(15)8-11(16)7-9/h2-8,14,18H,1H3
InChIKeyWTYSVECTNJCXKV-UHFFFAOYSA-N
XLogP4.66
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.06
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(4-bromo-2-fluorophenyl)-1-(2-fluorophenyl)-N-methylmethanamine
CID 114906280
1-(3-bromo-5-fluorophenyl)-N-methyl-1-(2-methylphenyl)methanamine
CID 66423844
1-(2-bromophenyl)-1-(2-fluorophenyl)-N-methylmethanamine
CID 55079167
1-(4-bromo-2-methylphenyl)-1-(2-fluorophenyl)-N-methylmethanamine
CID 115827845
1-(3,5-dibromophenyl)-1-(2-fluoro-3-methoxyphenyl)-N-methylmethanamine
CID 107976936
1-(3,5-dibromophenyl)-N-methyl-1-(2-propan-2-yloxyphenyl)methanamine
CID 107976659
1-(3-bromo-4-fluorophenyl)-1-(3,5-dibromophenyl)-N-methylmethanamine
CID 107979866
1-(2,4-difluorophenyl)-1-(2-fluorophenyl)-N-methylmethanamine
CID 43484143
1-(2-fluorophenyl)-N-methyl-1-(2,4,6-trifluorophenyl)methanamine
CID 43483217
1-(4-bromo-2-fluorophenyl)-1-(3,5-difluorophenyl)-N-methylmethanamine
CID 114906490
1-(2-fluorophenyl)-N-methyl-1-(2,3,4,5,6-pentafluorophenyl)methanamine
CID 115827734
1-(3-bromo-5-fluorophenyl)-1-(2-fluoro-4-methoxyphenyl)-N-methylmethanamine
CID 43561405

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-dibromophenyl)-1-(2-fluorophenyl)-N-methylmethanamine?
The IUPAC name of 1-(3,5-dibromophenyl)-1-(2-fluorophenyl)-N-methylmethanamine (CID 114022874) is 1-(3,5-dibromophenyl)-1-(2-fluorophenyl)-N-methylmethanamine.
What is the SMILES notation for 1-(3,5-dibromophenyl)-1-(2-fluorophenyl)-N-methylmethanamine?
The canonical SMILES for 1-(3,5-dibromophenyl)-1-(2-fluorophenyl)-N-methylmethanamine is CNC(c1cc(Br)cc(Br)c1)c1ccccc1F.
What is the InChIKey of 1-(3,5-dibromophenyl)-1-(2-fluorophenyl)-N-methylmethanamine?
The InChIKey is WTYSVECTNJCXKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Br2FN/c1-18-14(12-4-2-3-5-13(12)17)9-6-10(15)8-11(16)7-9/h2-8,14,18H,1H3.
What are the key properties of 1-(3,5-dibromophenyl)-1-(2-fluorophenyl)-N-methylmethanamine?
1-(3,5-dibromophenyl)-1-(2-fluorophenyl)-N-methylmethanamine has a molecular weight of 373.06 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-(3,5-dibromophenyl)-1-(2-fluorophenyl)-N-methylmethanamine is sourced from PubChem (CID 114022874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).