1-(2,4-dibromophenyl)-1-(2,4-difluorophenyl)-N-methylmethanamine

C14H11Br2F2N — CID 107945698

IUPAC1-(2,4-dibromophenyl)-1-(2,4-difluorophenyl)-N-methylmethanamine
SMILESCNC(c1ccc(F)cc1F)c1ccc(Br)cc1Br
InChIInChI=1S/C14H11Br2F2N/c1-19-14(10-4-2-8(15)6-12(10)16)11-5-3-9(17)7-13(11)18/h2-7,14,19H,1H3
InChIKeyNOVPQBOLCXIRGN-UHFFFAOYSA-N
MW391.05 g/mol
LogP4.80
Rot. Bonds3

About 1-(2,4-dibromophenyl)-1-(2,4-difluorophenyl)-N-methylmethanamine

1-(2,4-dibromophenyl)-1-(2,4-difluorophenyl)-N-methylmethanamine (PubChem CID 107945698) has the molecular formula C14H11Br2F2N and a molecular weight of 391.05 g/mol. Its IUPAC name is 1-(2,4-dibromophenyl)-1-(2,4-difluorophenyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(2,4-dibromophenyl)-1-(2,4-difluorophenyl)-N-methylmethanamine
PubChem CID107945698
Molecular FormulaC14H11Br2F2N
Molecular Weight391.05 g/mol
Exact Mass388.92
IUPAC Name1-(2,4-dibromophenyl)-1-(2,4-difluorophenyl)-N-methylmethanamine
SMILESCNC(c1ccc(F)cc1F)c1ccc(Br)cc1Br
InChIInChI=1S/C14H11Br2F2N/c1-19-14(10-4-2-8(15)6-12(10)16)11-5-3-9(17)7-13(11)18/h2-7,14,19H,1H3
InChIKeyNOVPQBOLCXIRGN-UHFFFAOYSA-N
XLogP4.80
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.05
LogP ≤ 54.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2-bromo-4-chlorophenyl)-1-(2,4-difluorophenyl)-N-methylmethanamine
CID 107987368
1-(2,4-dibromophenyl)-1-(4-fluorophenyl)-N-methylmethanamine
CID 107945033
1-(4-bromo-2-methoxyphenyl)-1-(2,4-difluorophenyl)-N-methylmethanamine
CID 115368891
1-(4-bromo-2-fluorophenyl)-1-(2,5-dibromophenyl)-N-methylmethanamine
CID 43482234
1-(4-bromo-2-fluorophenyl)-1-(4-fluorophenyl)-N-methylmethanamine
CID 43481266
1-(5-bromo-2-fluorophenyl)-1-(2,5-difluorophenyl)-N-methylmethanamine
CID 43482895
1-(4-bromo-2-fluorophenyl)-1-(2-fluorophenyl)-N-methylmethanamine
CID 114906280
1-(4-bromo-2-fluorophenyl)-1-(4-chloro-2-fluorophenyl)-N-methylmethanamine
CID 114906262
1-(4-bromo-3,5-dimethylphenyl)-1-(2,4-difluorophenyl)-N-methylmethanamine
CID 114330491
1-(2,4-difluorophenyl)-1-(2-fluorophenyl)-N-methylmethanamine
CID 43484143
1-(2-chloro-5-fluorophenyl)-1-(2,4-difluorophenyl)-N-methylmethanamine
CID 105394908
1-(4-bromo-2-fluorophenyl)-1-(3,5-difluorophenyl)-N-methylmethanamine
CID 114906490

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dibromophenyl)-1-(2,4-difluorophenyl)-N-methylmethanamine?
The IUPAC name of 1-(2,4-dibromophenyl)-1-(2,4-difluorophenyl)-N-methylmethanamine (CID 107945698) is 1-(2,4-dibromophenyl)-1-(2,4-difluorophenyl)-N-methylmethanamine.
What is the SMILES notation for 1-(2,4-dibromophenyl)-1-(2,4-difluorophenyl)-N-methylmethanamine?
The canonical SMILES for 1-(2,4-dibromophenyl)-1-(2,4-difluorophenyl)-N-methylmethanamine is CNC(c1ccc(F)cc1F)c1ccc(Br)cc1Br.
What is the InChIKey of 1-(2,4-dibromophenyl)-1-(2,4-difluorophenyl)-N-methylmethanamine?
The InChIKey is NOVPQBOLCXIRGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Br2F2N/c1-19-14(10-4-2-8(15)6-12(10)16)11-5-3-9(17)7-13(11)18/h2-7,14,19H,1H3.
What are the key properties of 1-(2,4-dibromophenyl)-1-(2,4-difluorophenyl)-N-methylmethanamine?
1-(2,4-dibromophenyl)-1-(2,4-difluorophenyl)-N-methylmethanamine has a molecular weight of 391.05 g/mol, XLogP of 4.80, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dibromophenyl)-1-(2,4-difluorophenyl)-N-methylmethanamine is sourced from PubChem (CID 107945698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).