2-(2-chloro-5-fluorophenyl)-1-(4-chlorophenyl)ethanamine

C14H12Cl2FN — CID 102618374

IUPAC2-(2-chloro-5-fluorophenyl)-1-(4-chlorophenyl)ethanamine
SMILESNC(Cc1cc(F)ccc1Cl)c1ccc(Cl)cc1
InChIInChI=1S/C14H12Cl2FN/c15-11-3-1-9(2-4-11)14(18)8-10-7-12(17)5-6-13(10)16/h1-7,14H,8,18H2
InChIKeyDSTPKJZHQIEUIZ-UHFFFAOYSA-N
MW284.16 g/mol
LogP4.38
Rot. Bonds3

About 2-(2-chloro-5-fluorophenyl)-1-(4-chlorophenyl)ethanamine

2-(2-chloro-5-fluorophenyl)-1-(4-chlorophenyl)ethanamine (PubChem CID 102618374) has the molecular formula C14H12Cl2FN and a molecular weight of 284.16 g/mol. Its IUPAC name is 2-(2-chloro-5-fluorophenyl)-1-(4-chlorophenyl)ethanamine.

Molecular Properties

Compound Name2-(2-chloro-5-fluorophenyl)-1-(4-chlorophenyl)ethanamine
PubChem CID102618374
Molecular FormulaC14H12Cl2FN
Molecular Weight284.16 g/mol
Exact Mass283.03
IUPAC Name2-(2-chloro-5-fluorophenyl)-1-(4-chlorophenyl)ethanamine
SMILESNC(Cc1cc(F)ccc1Cl)c1ccc(Cl)cc1
InChIInChI=1S/C14H12Cl2FN/c15-11-3-1-9(2-4-11)14(18)8-10-7-12(17)5-6-13(10)16/h1-7,14H,8,18H2
InChIKeyDSTPKJZHQIEUIZ-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-(2-chloro-5-fluorophenyl)-1-(3,4,5-trifluorophenyl)ethanamine
CID 102618763
1-(4-tert-butylphenyl)-2-(2-chloro-5-fluorophenyl)ethanamine
CID 102622505
2-(2-chloro-5-fluorophenyl)-1-(2,5-dichlorophenyl)ethanamine
CID 102622560
2-(2-chloro-5-fluorophenyl)-1-(3-fluoro-4-methylphenyl)ethanamine
CID 102618457
2-(2-chloro-5-fluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)ethanamine
CID 107503345
2-(2,5-dichlorophenyl)-1-(4-propan-2-ylphenyl)ethanamine
CID 65321175
1-(4-bromo-3-methylphenyl)-2-(2-chloro-5-fluorophenyl)ethanamine
CID 102622572
2-(2-bromo-5-fluorophenyl)-1-(3-chloro-4-fluorophenyl)ethanamine
CID 63094668
1-(4-chloro-3-fluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanamine
CID 107995696
2-(2-chloro-5-fluorophenyl)-1-(2-chlorophenyl)ethanamine
CID 102618794
2-(2-chloro-5-fluorophenyl)-1-(3,4-difluorophenyl)-N-methylethanamine
CID 102618536
1-(4-chlorophenyl)-2-(3-fluorophenyl)ethanamine
CID 43184847

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-5-fluorophenyl)-1-(4-chlorophenyl)ethanamine?
The IUPAC name of 2-(2-chloro-5-fluorophenyl)-1-(4-chlorophenyl)ethanamine (CID 102618374) is 2-(2-chloro-5-fluorophenyl)-1-(4-chlorophenyl)ethanamine.
What is the SMILES notation for 2-(2-chloro-5-fluorophenyl)-1-(4-chlorophenyl)ethanamine?
The canonical SMILES for 2-(2-chloro-5-fluorophenyl)-1-(4-chlorophenyl)ethanamine is NC(Cc1cc(F)ccc1Cl)c1ccc(Cl)cc1.
What is the InChIKey of 2-(2-chloro-5-fluorophenyl)-1-(4-chlorophenyl)ethanamine?
The InChIKey is DSTPKJZHQIEUIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2FN/c15-11-3-1-9(2-4-11)14(18)8-10-7-12(17)5-6-13(10)16/h1-7,14H,8,18H2.
What are the key properties of 2-(2-chloro-5-fluorophenyl)-1-(4-chlorophenyl)ethanamine?
2-(2-chloro-5-fluorophenyl)-1-(4-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-(4-chlorophenyl)ethanamine is sourced from PubChem (CID 102618374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).