1-(2,6-difluorophenyl)-N-methyl-1-(2,4,6-trifluorophenyl)methanamine

C14H10F5N — CID 43483206

IUPAC1-(2,6-difluorophenyl)-N-methyl-1-(2,4,6-trifluorophenyl)methanamine
SMILESCNC(c1c(F)cccc1F)c1c(F)cc(F)cc1F
InChIInChI=1S/C14H10F5N/c1-20-14(12-8(16)3-2-4-9(12)17)13-10(18)5-7(15)6-11(13)19/h2-6,14,20H,1H3
InChIKeyZHXOXXFSOZEMKS-UHFFFAOYSA-N
MW287.23 g/mol
LogP3.69
Rot. Bonds3

About 1-(2,6-difluorophenyl)-N-methyl-1-(2,4,6-trifluorophenyl)methanamine

1-(2,6-difluorophenyl)-N-methyl-1-(2,4,6-trifluorophenyl)methanamine (PubChem CID 43483206) has the molecular formula C14H10F5N and a molecular weight of 287.23 g/mol. Its IUPAC name is 1-(2,6-difluorophenyl)-N-methyl-1-(2,4,6-trifluorophenyl)methanamine.

Molecular Properties

Compound Name1-(2,6-difluorophenyl)-N-methyl-1-(2,4,6-trifluorophenyl)methanamine
PubChem CID43483206
Molecular FormulaC14H10F5N
Molecular Weight287.23 g/mol
Exact Mass287.07
IUPAC Name1-(2,6-difluorophenyl)-N-methyl-1-(2,4,6-trifluorophenyl)methanamine
SMILESCNC(c1c(F)cccc1F)c1c(F)cc(F)cc1F
InChIInChI=1S/C14H10F5N/c1-20-14(12-8(16)3-2-4-9(12)17)13-10(18)5-7(15)6-11(13)19/h2-6,14,20H,1H3
InChIKeyZHXOXXFSOZEMKS-UHFFFAOYSA-N
XLogP3.69
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.23
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2-chloro-6-fluorophenyl)-N-methyl-1-(2,4,6-trifluorophenyl)methanamine
CID 43483251
1-(2-fluorophenyl)-N-methyl-1-(2,4,6-trifluorophenyl)methanamine
CID 43483217
1-(2,5-difluorophenyl)-1-(2,6-difluorophenyl)-N-methylmethanamine
CID 43482919
1-(3,5-dichlorophenyl)-1-(2,6-difluorophenyl)-N-methylmethanamine
CID 115859907
1-(2,6-difluorophenyl)-1-(5-fluoro-2-pyridinyl)-N-methylmethanamine
CID 79712535
1-(5-bromo-2-fluorophenyl)-N-methyl-1-(2,4,6-trifluorophenyl)methanamine
CID 43483186
1-(2,6-difluorophenyl)-N-methyl-1-(5-methylfuran-3-yl)methanamine
CID 115859709
1-(2,6-difluorophenyl)-N-methyl-1-pyrimidin-5-ylmethanamine
CID 79522798
1-(2,5-dichlorothiophen-3-yl)-1-(2,6-difluorophenyl)-N-methylmethanamine
CID 43486798
1-(2,6-difluorophenyl)-1-(3,4-dimethoxyphenyl)-N-methylmethanamine
CID 43481181
1-(3-fluoro-4-methoxyphenyl)-N-methyl-1-(2,4,6-trifluorophenyl)methanamine
CID 62919545
1-(3-chloro-4-iodophenyl)-1-(2,6-difluorophenyl)-N-methylmethanamine
CID 103215327

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-difluorophenyl)-N-methyl-1-(2,4,6-trifluorophenyl)methanamine?
The IUPAC name of 1-(2,6-difluorophenyl)-N-methyl-1-(2,4,6-trifluorophenyl)methanamine (CID 43483206) is 1-(2,6-difluorophenyl)-N-methyl-1-(2,4,6-trifluorophenyl)methanamine.
What is the SMILES notation for 1-(2,6-difluorophenyl)-N-methyl-1-(2,4,6-trifluorophenyl)methanamine?
The canonical SMILES for 1-(2,6-difluorophenyl)-N-methyl-1-(2,4,6-trifluorophenyl)methanamine is CNC(c1c(F)cccc1F)c1c(F)cc(F)cc1F.
What is the InChIKey of 1-(2,6-difluorophenyl)-N-methyl-1-(2,4,6-trifluorophenyl)methanamine?
The InChIKey is ZHXOXXFSOZEMKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10F5N/c1-20-14(12-8(16)3-2-4-9(12)17)13-10(18)5-7(15)6-11(13)19/h2-6,14,20H,1H3.
What are the key properties of 1-(2,6-difluorophenyl)-N-methyl-1-(2,4,6-trifluorophenyl)methanamine?
1-(2,6-difluorophenyl)-N-methyl-1-(2,4,6-trifluorophenyl)methanamine has a molecular weight of 287.23 g/mol, XLogP of 3.69, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-difluorophenyl)-N-methyl-1-(2,4,6-trifluorophenyl)methanamine is sourced from PubChem (CID 43483206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).