1-(2,6-dichlorophenyl)-2-(3-fluorophenyl)ethanamine

C14H12Cl2FN — CID 61079265

IUPAC1-(2,6-dichlorophenyl)-2-(3-fluorophenyl)ethanamine
SMILESNC(Cc1cccc(F)c1)c1c(Cl)cccc1Cl
InChIInChI=1S/C14H12Cl2FN/c15-11-5-2-6-12(16)14(11)13(18)8-9-3-1-4-10(17)7-9/h1-7,13H,8,18H2
InChIKeyHRNQEZRWONZERS-UHFFFAOYSA-N
MW284.16 g/mol
LogP4.38
Rot. Bonds3

About 1-(2,6-dichlorophenyl)-2-(3-fluorophenyl)ethanamine

1-(2,6-dichlorophenyl)-2-(3-fluorophenyl)ethanamine (PubChem CID 61079265) has the molecular formula C14H12Cl2FN and a molecular weight of 284.16 g/mol. Its IUPAC name is 1-(2,6-dichlorophenyl)-2-(3-fluorophenyl)ethanamine.

Molecular Properties

Compound Name1-(2,6-dichlorophenyl)-2-(3-fluorophenyl)ethanamine
PubChem CID61079265
Molecular FormulaC14H12Cl2FN
Molecular Weight284.16 g/mol
Exact Mass283.03
IUPAC Name1-(2,6-dichlorophenyl)-2-(3-fluorophenyl)ethanamine
SMILESNC(Cc1cccc(F)c1)c1c(Cl)cccc1Cl
InChIInChI=1S/C14H12Cl2FN/c15-11-5-2-6-12(16)14(11)13(18)8-9-3-1-4-10(17)7-9/h1-7,13H,8,18H2
InChIKeyHRNQEZRWONZERS-UHFFFAOYSA-N
XLogP4.38
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.16
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(3-bromo-5-fluorophenyl)-1-(2,6-dichlorophenyl)ethanamine
CID 105015454
[1-(2,6-dichlorophenyl)-2-(3-fluorophenyl)ethyl]hydrazine
CID 105286398
1-(2,5-dichlorophenyl)-2-(3-fluorophenyl)ethanamine
CID 43344680
1-(4-chlorophenyl)-2-(3-fluorophenyl)ethanamine
CID 43184847
1-(2,6-dichlorophenyl)-2-(3-fluorophenyl)-N-methylethanamine
CID 61063993
2-[(2,6-dichlorophenyl)methyl]-3-(3-fluorophenyl)propan-1-amine
CID 63496881
1-(2-bromo-6-fluorophenyl)-2-(3-fluorophenyl)ethanamine
CID 114559896
1-(2,6-dichlorophenyl)-2-(5-fluoro-2-methylphenyl)ethanamine
CID 105376936
2-(3-fluorophenyl)-1-phenylethanamine;hydrochloride
CID 25032833
N-[1-(2,6-dichlorophenyl)-2-(3-fluorophenyl)ethyl]propan-1-amine
CID 63528797
2-(3,4-dichlorophenyl)-1-(2,6-difluorophenyl)ethanamine
CID 63044768
1-(4-chloro-1-propan-2-ylpyrazol-5-yl)-2-(3-fluorophenyl)ethanamine
CID 114648271

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dichlorophenyl)-2-(3-fluorophenyl)ethanamine?
The IUPAC name of 1-(2,6-dichlorophenyl)-2-(3-fluorophenyl)ethanamine (CID 61079265) is 1-(2,6-dichlorophenyl)-2-(3-fluorophenyl)ethanamine.
What is the SMILES notation for 1-(2,6-dichlorophenyl)-2-(3-fluorophenyl)ethanamine?
The canonical SMILES for 1-(2,6-dichlorophenyl)-2-(3-fluorophenyl)ethanamine is NC(Cc1cccc(F)c1)c1c(Cl)cccc1Cl.
What is the InChIKey of 1-(2,6-dichlorophenyl)-2-(3-fluorophenyl)ethanamine?
The InChIKey is HRNQEZRWONZERS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2FN/c15-11-5-2-6-12(16)14(11)13(18)8-9-3-1-4-10(17)7-9/h1-7,13H,8,18H2.
What are the key properties of 1-(2,6-dichlorophenyl)-2-(3-fluorophenyl)ethanamine?
1-(2,6-dichlorophenyl)-2-(3-fluorophenyl)ethanamine has a molecular weight of 284.16 g/mol, XLogP of 4.38, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-dichlorophenyl)-2-(3-fluorophenyl)ethanamine is sourced from PubChem (CID 61079265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).