N-(2,4-dibromophenyl)-1-(3-fluorophenyl)methanimine

C13H8Br2FN — CID 23329288

IUPACN-(2,4-dibromophenyl)-1-(3-fluorophenyl)methanimine
SMILESFc1cccc(/C=N/c2ccc(Br)cc2Br)c1
InChIInChI=1S/C13H8Br2FN/c14-10-4-5-13(12(15)7-10)17-8-9-2-1-3-11(16)6-9/h1-8H/b17-8+
InChIKeyDAWNEEUPOZAGSJ-CAOOACKPSA-N
MW357.02 g/mol
LogP5.10
Rot. Bonds2

About N-(2,4-dibromophenyl)-1-(3-fluorophenyl)methanimine

N-(2,4-dibromophenyl)-1-(3-fluorophenyl)methanimine (PubChem CID 23329288) has the molecular formula C13H8Br2FN and a molecular weight of 357.02 g/mol. Its IUPAC name is N-(2,4-dibromophenyl)-1-(3-fluorophenyl)methanimine.

Molecular Properties

Compound NameN-(2,4-dibromophenyl)-1-(3-fluorophenyl)methanimine
PubChem CID23329288
Molecular FormulaC13H8Br2FN
Molecular Weight357.02 g/mol
Exact Mass354.90
IUPAC NameN-(2,4-dibromophenyl)-1-(3-fluorophenyl)methanimine
SMILESFc1cccc(/C=N/c2ccc(Br)cc2Br)c1
InChIInChI=1S/C13H8Br2FN/c14-10-4-5-13(12(15)7-10)17-8-9-2-1-3-11(16)6-9/h1-8H/b17-8+
InChIKeyDAWNEEUPOZAGSJ-CAOOACKPSA-N
XLogP5.10
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500357.02
LogP ≤ 55.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

1-(3-bromophenyl)-N-(4-fluorophenyl)methanimine
CID 139243964
N-(2,4-dibromophenyl)-1-naphthalen-1-ylmethanimine
CID 21210393
1-bromo-3-fluorobenzene;sulfane
CID 174932611
5-bromo-2-[(3-methoxyphenyl)methylideneamino]phenol
CID 142246969
N-(3-bromo-2-fluorophenyl)-1-phenylmethanimine
CID 169130471
2-(benzylideneamino)-5-bromobenzonitrile
CID 70612368
N'-(2,4-dibromophenyl)-N-hydroxymethanimidamide
CID 20763256
1-bromo-3-[(E)-3,3-dimethylbut-1-enyl]benzene;1-[(E)-3,3-dimethylbut-1-enyl]-3-fluorobenzene
CID 157326313
N-(2,4-difluorophenyl)-1-(3-nitrophenyl)methanimine
CID 122707231
N-[(E)-(3-bromophenyl)methylideneamino]-3-fluorobenzamide
CID 5332626
N-(2,5-difluorophenyl)-1-(3,5-difluorophenyl)methanimine
CID 139199985
6-bromo-3-[(3-fluorophenyl)methylideneamino]-2-methylquinazolin-4-one
CID 126305274

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dibromophenyl)-1-(3-fluorophenyl)methanimine?
The IUPAC name of N-(2,4-dibromophenyl)-1-(3-fluorophenyl)methanimine (CID 23329288) is N-(2,4-dibromophenyl)-1-(3-fluorophenyl)methanimine.
What is the SMILES notation for N-(2,4-dibromophenyl)-1-(3-fluorophenyl)methanimine?
The canonical SMILES for N-(2,4-dibromophenyl)-1-(3-fluorophenyl)methanimine is Fc1cccc(/C=N/c2ccc(Br)cc2Br)c1.
What is the InChIKey of N-(2,4-dibromophenyl)-1-(3-fluorophenyl)methanimine?
The InChIKey is DAWNEEUPOZAGSJ-CAOOACKPSA-N. The full InChI is InChI=1S/C13H8Br2FN/c14-10-4-5-13(12(15)7-10)17-8-9-2-1-3-11(16)6-9/h1-8H/b17-8+.
What are the key properties of N-(2,4-dibromophenyl)-1-(3-fluorophenyl)methanimine?
N-(2,4-dibromophenyl)-1-(3-fluorophenyl)methanimine has a molecular weight of 357.02 g/mol, XLogP of 5.10, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dibromophenyl)-1-(3-fluorophenyl)methanimine is sourced from PubChem (CID 23329288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).