1-(3-chloro-2-fluorophenyl)-2-(2-fluorophenyl)ethanamine

C14H12ClF2N — CID 64713277

IUPAC1-(3-chloro-2-fluorophenyl)-2-(2-fluorophenyl)ethanamine
SMILESNC(Cc1ccccc1F)c1cccc(Cl)c1F
InChIInChI=1S/C14H12ClF2N/c15-11-6-3-5-10(14(11)17)13(18)8-9-4-1-2-7-12(9)16/h1-7,13H,8,18H2
InChIKeyPUKFHOGBYFSYGA-UHFFFAOYSA-N
MW267.71 g/mol
LogP3.86
Rot. Bonds3

About 1-(3-chloro-2-fluorophenyl)-2-(2-fluorophenyl)ethanamine

1-(3-chloro-2-fluorophenyl)-2-(2-fluorophenyl)ethanamine (PubChem CID 64713277) has the molecular formula C14H12ClF2N and a molecular weight of 267.71 g/mol. Its IUPAC name is 1-(3-chloro-2-fluorophenyl)-2-(2-fluorophenyl)ethanamine.

Molecular Properties

Compound Name1-(3-chloro-2-fluorophenyl)-2-(2-fluorophenyl)ethanamine
PubChem CID64713277
Molecular FormulaC14H12ClF2N
Molecular Weight267.71 g/mol
Exact Mass267.06
IUPAC Name1-(3-chloro-2-fluorophenyl)-2-(2-fluorophenyl)ethanamine
SMILESNC(Cc1ccccc1F)c1cccc(Cl)c1F
InChIInChI=1S/C14H12ClF2N/c15-11-6-3-5-10(14(11)17)13(18)8-9-4-1-2-7-12(9)16/h1-7,13H,8,18H2
InChIKeyPUKFHOGBYFSYGA-UHFFFAOYSA-N
XLogP3.86
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.71
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2-chloro-3-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanamine
CID 102866438
1-(3-chloro-2-fluorophenyl)-2-(2,5-difluorophenyl)ethanamine
CID 64714150
1-(3-chloro-2-fluorophenyl)-2-(2,6-dichlorophenyl)ethanamine
CID 64713656
2-(3-chloro-2-fluorophenyl)-1-(2,3,4-trifluorophenyl)ethanamine
CID 82806473
2-(2-chloro-3-fluorophenyl)-1-(2-fluoro-3-methylphenyl)ethanamine
CID 105032385
2-(3-chloro-2-fluorophenyl)-1-(5-chloro-2-fluorophenyl)ethanamine
CID 102858038
1-(4-chloronaphthalen-1-yl)-2-(2-fluorophenyl)ethanamine
CID 79591908
1-(2-chlorofuran-3-yl)-2-(2-fluorophenyl)ethanamine
CID 106687760
1-(3-bromo-2-chlorophenyl)-2-(3-chloro-2-fluorophenyl)ethanamine
CID 102866631
1-(3-chloro-2-fluorophenyl)-2-(2,5-dimethylphenyl)ethanamine
CID 64713976
2-(3-chloro-2-fluorophenyl)-1-(2-fluorophenyl)ethanol
CID 82802842
(1R)-1-(3-chloro-2-fluorophenyl)butane-1,4-diamine
CID 171209299

Frequently Asked Questions

What is the IUPAC name of 1-(3-chloro-2-fluorophenyl)-2-(2-fluorophenyl)ethanamine?
The IUPAC name of 1-(3-chloro-2-fluorophenyl)-2-(2-fluorophenyl)ethanamine (CID 64713277) is 1-(3-chloro-2-fluorophenyl)-2-(2-fluorophenyl)ethanamine.
What is the SMILES notation for 1-(3-chloro-2-fluorophenyl)-2-(2-fluorophenyl)ethanamine?
The canonical SMILES for 1-(3-chloro-2-fluorophenyl)-2-(2-fluorophenyl)ethanamine is NC(Cc1ccccc1F)c1cccc(Cl)c1F.
What is the InChIKey of 1-(3-chloro-2-fluorophenyl)-2-(2-fluorophenyl)ethanamine?
The InChIKey is PUKFHOGBYFSYGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClF2N/c15-11-6-3-5-10(14(11)17)13(18)8-9-4-1-2-7-12(9)16/h1-7,13H,8,18H2.
What are the key properties of 1-(3-chloro-2-fluorophenyl)-2-(2-fluorophenyl)ethanamine?
1-(3-chloro-2-fluorophenyl)-2-(2-fluorophenyl)ethanamine has a molecular weight of 267.71 g/mol, XLogP of 3.86, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chloro-2-fluorophenyl)-2-(2-fluorophenyl)ethanamine is sourced from PubChem (CID 64713277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).