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

C14H12F3N — CID 43484143

IUPAC1-(2,4-difluorophenyl)-1-(2-fluorophenyl)-N-methylmethanamine
SMILESCNC(c1ccccc1F)c1ccc(F)cc1F
InChIInChI=1S/C14H12F3N/c1-18-14(10-4-2-3-5-12(10)16)11-7-6-9(15)8-13(11)17/h2-8,14,18H,1H3
InChIKeyYUBUYBKEZRVXBI-UHFFFAOYSA-N
MW251.25 g/mol
LogP3.41
Rot. Bonds3

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

1-(2,4-difluorophenyl)-1-(2-fluorophenyl)-N-methylmethanamine (PubChem CID 43484143) has the molecular formula C14H12F3N and a molecular weight of 251.25 g/mol. Its IUPAC name is 1-(2,4-difluorophenyl)-1-(2-fluorophenyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(2,4-difluorophenyl)-1-(2-fluorophenyl)-N-methylmethanamine
PubChem CID43484143
Molecular FormulaC14H12F3N
Molecular Weight251.25 g/mol
Exact Mass251.09
IUPAC Name1-(2,4-difluorophenyl)-1-(2-fluorophenyl)-N-methylmethanamine
SMILESCNC(c1ccccc1F)c1ccc(F)cc1F
InChIInChI=1S/C14H12F3N/c1-18-14(10-4-2-3-5-12(10)16)11-7-6-9(15)8-13(11)17/h2-8,14,18H,1H3
InChIKeyYUBUYBKEZRVXBI-UHFFFAOYSA-N
XLogP3.41
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.25
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2,3-difluorophenyl)-1-(2,4-difluorophenyl)-N-methylmethanamine
CID 62649351
1-(2,4-difluorophenyl)-N-methyl-1-phenylmethanamine
CID 43481546
1-(4-bromo-2-fluorophenyl)-1-(2-fluorophenyl)-N-methylmethanamine
CID 114906280
1-(2-chloro-5-fluorophenyl)-1-(2,4-difluorophenyl)-N-methylmethanamine
CID 105394908
1-(2-fluorophenyl)-N-methyl-1-(2,4,6-trifluorophenyl)methanamine
CID 43483217
1-(2,4-difluorophenyl)-N-methyl-1-(2-propoxyphenyl)methanamine
CID 104660094
1-(2,4-difluorophenyl)-N-methyl-1-(2-methylfuran-3-yl)methanamine
CID 43484074
1-(2,4-dibromophenyl)-1-(2,4-difluorophenyl)-N-methylmethanamine
CID 107945698
1-(2,4-difluorophenyl)-N-methyl-1-quinoxalin-5-ylmethanamine
CID 105143729
1-(2-bromophenyl)-1-(2-fluorophenyl)-N-methylmethanamine
CID 55079167
1-(2-bromo-4-chlorophenyl)-1-(2,4-difluorophenyl)-N-methylmethanamine
CID 107987368
1-(2-chloro-4-methylphenyl)-1-(2,4-difluorophenyl)-N-methylmethanamine
CID 106857516

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-difluorophenyl)-1-(2-fluorophenyl)-N-methylmethanamine?
The IUPAC name of 1-(2,4-difluorophenyl)-1-(2-fluorophenyl)-N-methylmethanamine (CID 43484143) is 1-(2,4-difluorophenyl)-1-(2-fluorophenyl)-N-methylmethanamine.
What is the SMILES notation for 1-(2,4-difluorophenyl)-1-(2-fluorophenyl)-N-methylmethanamine?
The canonical SMILES for 1-(2,4-difluorophenyl)-1-(2-fluorophenyl)-N-methylmethanamine is CNC(c1ccccc1F)c1ccc(F)cc1F.
What is the InChIKey of 1-(2,4-difluorophenyl)-1-(2-fluorophenyl)-N-methylmethanamine?
The InChIKey is YUBUYBKEZRVXBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12F3N/c1-18-14(10-4-2-3-5-12(10)16)11-7-6-9(15)8-13(11)17/h2-8,14,18H,1H3.
What are the key properties of 1-(2,4-difluorophenyl)-1-(2-fluorophenyl)-N-methylmethanamine?
1-(2,4-difluorophenyl)-1-(2-fluorophenyl)-N-methylmethanamine has a molecular weight of 251.25 g/mol, XLogP of 3.41, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-difluorophenyl)-1-(2-fluorophenyl)-N-methylmethanamine is sourced from PubChem (CID 43484143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).