2-(2-chloro-5-fluorophenyl)-1-(2-chlorophenyl)ethanamine

C14H12Cl2FN — CID 102618794

IUPAC2-(2-chloro-5-fluorophenyl)-1-(2-chlorophenyl)ethanamine
SMILESNC(Cc1cc(F)ccc1Cl)c1ccccc1Cl
InChIInChI=1S/C14H12Cl2FN/c15-12-6-5-10(17)7-9(12)8-14(18)11-3-1-2-4-13(11)16/h1-7,14H,8,18H2
InChIKeyXCCDGMRCLFJVDH-UHFFFAOYSA-N
MW284.16 g/mol
LogP4.38
Rot. Bonds3

About 2-(2-chloro-5-fluorophenyl)-1-(2-chlorophenyl)ethanamine

2-(2-chloro-5-fluorophenyl)-1-(2-chlorophenyl)ethanamine (PubChem CID 102618794) has the molecular formula C14H12Cl2FN and a molecular weight of 284.16 g/mol. Its IUPAC name is 2-(2-chloro-5-fluorophenyl)-1-(2-chlorophenyl)ethanamine.

Molecular Properties

Compound Name2-(2-chloro-5-fluorophenyl)-1-(2-chlorophenyl)ethanamine
PubChem CID102618794
Molecular FormulaC14H12Cl2FN
Molecular Weight284.16 g/mol
Exact Mass283.03
IUPAC Name2-(2-chloro-5-fluorophenyl)-1-(2-chlorophenyl)ethanamine
SMILESNC(Cc1cc(F)ccc1Cl)c1ccccc1Cl
InChIInChI=1S/C14H12Cl2FN/c15-12-6-5-10(17)7-9(12)8-14(18)11-3-1-2-4-13(11)16/h1-7,14H,8,18H2
InChIKeyXCCDGMRCLFJVDH-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

1-(2-chloro-5-fluorophenyl)-2-(2-chlorophenyl)ethanamine
CID 105394821
2-(2-chloro-5-fluorophenyl)-1-[2-(trifluoromethyl)phenyl]ethanamine
CID 102622579
2-(2-chloro-5-fluorophenyl)-1-(2-methylsulfanylphenyl)ethanamine
CID 102622535
2-(2-chloro-5-fluorophenyl)-1-(2,5-dichlorophenyl)ethanamine
CID 102622560
2-(2-chlorophenyl)-1-(2,5-difluorophenyl)ethanamine
CID 43197901
3-(2-chloro-5-fluorophenyl)-2-(2-chlorophenyl)propan-1-amine
CID 102619974
2-(2-chloro-5-fluorophenyl)-1-(3-chloro-4-pyridinyl)ethanamine
CID 102622472
1-(3-chloro-2-fluorophenyl)-2-(2,5-difluorophenyl)ethanamine
CID 64714150
2-(2-chloro-5-fluorophenyl)-1-(4-chlorophenyl)ethanamine
CID 102618374
2-(2-chloro-5-fluorophenyl)-1-(3,4,5-trifluorophenyl)ethanamine
CID 102618763
2-(2-chloro-4-fluorophenyl)-1-(2-methylphenyl)ethanamine
CID 55095442
1-(2-chloro-4-fluorophenyl)-2-(2,4-difluorophenyl)ethanamine
CID 55152610

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-5-fluorophenyl)-1-(2-chlorophenyl)ethanamine?
The IUPAC name of 2-(2-chloro-5-fluorophenyl)-1-(2-chlorophenyl)ethanamine (CID 102618794) is 2-(2-chloro-5-fluorophenyl)-1-(2-chlorophenyl)ethanamine.
What is the SMILES notation for 2-(2-chloro-5-fluorophenyl)-1-(2-chlorophenyl)ethanamine?
The canonical SMILES for 2-(2-chloro-5-fluorophenyl)-1-(2-chlorophenyl)ethanamine is NC(Cc1cc(F)ccc1Cl)c1ccccc1Cl.
What is the InChIKey of 2-(2-chloro-5-fluorophenyl)-1-(2-chlorophenyl)ethanamine?
The InChIKey is XCCDGMRCLFJVDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2FN/c15-12-6-5-10(17)7-9(12)8-14(18)11-3-1-2-4-13(11)16/h1-7,14H,8,18H2.
What are the key properties of 2-(2-chloro-5-fluorophenyl)-1-(2-chlorophenyl)ethanamine?
2-(2-chloro-5-fluorophenyl)-1-(2-chlorophenyl)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 2-(2-chloro-5-fluorophenyl)-1-(2-chlorophenyl)ethanamine is sourced from PubChem (CID 102618794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).