2-(2-chlorophenyl)-2-(3,5-difluorophenoxy)ethanamine

C14H12ClF2NO — CID 62785210

IUPAC2-(2-chlorophenyl)-2-(3,5-difluorophenoxy)ethanamine
SMILESNCC(Oc1cc(F)cc(F)c1)c1ccccc1Cl
InChIInChI=1S/C14H12ClF2NO/c15-13-4-2-1-3-12(13)14(8-18)19-11-6-9(16)5-10(17)7-11/h1-7,14H,8,18H2
InChIKeyGDCLNKKLBYAIEH-UHFFFAOYSA-N
MW283.71 g/mol
LogP3.70
Rot. Bonds4

About 2-(2-chlorophenyl)-2-(3,5-difluorophenoxy)ethanamine

2-(2-chlorophenyl)-2-(3,5-difluorophenoxy)ethanamine (PubChem CID 62785210) has the molecular formula C14H12ClF2NO and a molecular weight of 283.71 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-2-(3,5-difluorophenoxy)ethanamine.

Molecular Properties

Compound Name2-(2-chlorophenyl)-2-(3,5-difluorophenoxy)ethanamine
PubChem CID62785210
Molecular FormulaC14H12ClF2NO
Molecular Weight283.71 g/mol
Exact Mass283.06
IUPAC Name2-(2-chlorophenyl)-2-(3,5-difluorophenoxy)ethanamine
SMILESNCC(Oc1cc(F)cc(F)c1)c1ccccc1Cl
InChIInChI=1S/C14H12ClF2NO/c15-13-4-2-1-3-12(13)14(8-18)19-11-6-9(16)5-10(17)7-11/h1-7,14H,8,18H2
InChIKeyGDCLNKKLBYAIEH-UHFFFAOYSA-N
XLogP3.70
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.71
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-chlorophenyl)-2-(3,4-dichlorophenoxy)ethanamine
CID 55022380
2-(2-chlorophenyl)-2-(4-ethylphenoxy)ethanamine
CID 55022375
2-(2-bromophenoxy)-2-(2-chlorophenyl)ethanamine
CID 55022574
2-(2-chlorophenyl)-2-(4-propylphenoxy)ethanamine
CID 63459216
3-amino-1-(2-chlorophenyl)-2-(3,5-difluorophenyl)propan-1-ol
CID 65189186
[2-[2-amino-1-(2-chlorophenyl)ethoxy]phenyl]methanol
CID 63653081
2-(2-chlorophenyl)-2-[(2-chlorophenyl)methoxy]ethanamine
CID 55022331
2-(2-chlorophenyl)-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine
CID 66275640
2-(3-chloro-4-fluorophenoxy)-2-(3-fluorophenyl)ethanamine
CID 63879326
1-(2-chlorophenyl)-1-(3-fluorophenoxy)propan-2-amine
CID 55022859
2-(2-bromophenyl)-2-(3,5-dimethylphenoxy)ethanamine
CID 55022743
2-(3-ethoxyphenoxy)-2-(2-fluorophenyl)ethanamine
CID 62337852

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-2-(3,5-difluorophenoxy)ethanamine?
The IUPAC name of 2-(2-chlorophenyl)-2-(3,5-difluorophenoxy)ethanamine (CID 62785210) is 2-(2-chlorophenyl)-2-(3,5-difluorophenoxy)ethanamine.
What is the SMILES notation for 2-(2-chlorophenyl)-2-(3,5-difluorophenoxy)ethanamine?
The canonical SMILES for 2-(2-chlorophenyl)-2-(3,5-difluorophenoxy)ethanamine is NCC(Oc1cc(F)cc(F)c1)c1ccccc1Cl.
What is the InChIKey of 2-(2-chlorophenyl)-2-(3,5-difluorophenoxy)ethanamine?
The InChIKey is GDCLNKKLBYAIEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClF2NO/c15-13-4-2-1-3-12(13)14(8-18)19-11-6-9(16)5-10(17)7-11/h1-7,14H,8,18H2.
What are the key properties of 2-(2-chlorophenyl)-2-(3,5-difluorophenoxy)ethanamine?
2-(2-chlorophenyl)-2-(3,5-difluorophenoxy)ethanamine has a molecular weight of 283.71 g/mol, XLogP of 3.70, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-2-(3,5-difluorophenoxy)ethanamine is sourced from PubChem (CID 62785210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).