2-fluoro-N-[1-(2-fluorophenyl)ethyl]aniline

C14H13F2N — CID 43194893

IUPAC2-fluoro-N-[1-(2-fluorophenyl)ethyl]aniline
SMILESCC(Nc1ccccc1F)c1ccccc1F
InChIInChI=1S/C14H13F2N/c1-10(11-6-2-3-7-12(11)15)17-14-9-5-4-8-13(14)16/h2-10,17H,1H3
InChIKeyDTLZLTJIPLIBJG-UHFFFAOYSA-N
MW233.26 g/mol
LogP4.14
Rot. Bonds3

About 2-fluoro-N-[1-(2-fluorophenyl)ethyl]aniline

2-fluoro-N-[1-(2-fluorophenyl)ethyl]aniline (PubChem CID 43194893) has the molecular formula C14H13F2N and a molecular weight of 233.26 g/mol. Its IUPAC name is 2-fluoro-N-[1-(2-fluorophenyl)ethyl]aniline.

Molecular Properties

Compound Name2-fluoro-N-[1-(2-fluorophenyl)ethyl]aniline
PubChem CID43194893
Molecular FormulaC14H13F2N
Molecular Weight233.26 g/mol
Exact Mass233.10
IUPAC Name2-fluoro-N-[1-(2-fluorophenyl)ethyl]aniline
SMILESCC(Nc1ccccc1F)c1ccccc1F
InChIInChI=1S/C14H13F2N/c1-10(11-6-2-3-7-12(11)15)17-14-9-5-4-8-13(14)16/h2-10,17H,1H3
InChIKeyDTLZLTJIPLIBJG-UHFFFAOYSA-N
XLogP4.14
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.26
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,3,4-trifluoro-N-[1-(2-fluorophenyl)ethyl]aniline
CID 43192515
N-[1-(2-fluorophenyl)ethyl]-2-methylsulfonylaniline
CID 43232220
N-[1-(2-ethoxyphenyl)ethyl]-2-fluoroaniline
CID 43194923
2,4,5-trichloro-N-[1-(2-fluorophenyl)ethyl]aniline
CID 43108233
N-[1-(2-fluorophenyl)ethyl]-2-methoxypyridin-3-amine
CID 43721902
3-fluoro-4-[1-(2-fluorophenyl)ethylamino]benzoic acid
CID 62710157
2-amino-3-[1-(2-fluorophenyl)ethylamino]benzoic acid
CID 115545326
2-bromo-6-[1-(2-fluorophenyl)ethylamino]benzoic acid
CID 114887955
N-[(1R)-1-(2-fluorophenyl)ethyl]pyridin-4-amine
CID 94222755
4-chloro-N-[(1R)-1-(2-fluorophenyl)ethyl]aniline
CID 29291765
2-fluoro-N-[1-(2-fluorophenyl)propyl]aniline
CID 112676866
5-bromo-4-fluoro-N-[1-(2-fluorophenyl)ethyl]-2-methylaniline
CID 107591660

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-[1-(2-fluorophenyl)ethyl]aniline?
The IUPAC name of 2-fluoro-N-[1-(2-fluorophenyl)ethyl]aniline (CID 43194893) is 2-fluoro-N-[1-(2-fluorophenyl)ethyl]aniline.
What is the SMILES notation for 2-fluoro-N-[1-(2-fluorophenyl)ethyl]aniline?
The canonical SMILES for 2-fluoro-N-[1-(2-fluorophenyl)ethyl]aniline is CC(Nc1ccccc1F)c1ccccc1F.
What is the InChIKey of 2-fluoro-N-[1-(2-fluorophenyl)ethyl]aniline?
The InChIKey is DTLZLTJIPLIBJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13F2N/c1-10(11-6-2-3-7-12(11)15)17-14-9-5-4-8-13(14)16/h2-10,17H,1H3.
What are the key properties of 2-fluoro-N-[1-(2-fluorophenyl)ethyl]aniline?
2-fluoro-N-[1-(2-fluorophenyl)ethyl]aniline has a molecular weight of 233.26 g/mol, XLogP of 4.14, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-[1-(2-fluorophenyl)ethyl]aniline is sourced from PubChem (CID 43194893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).