4-(2-aminophenoxy)-3-fluoroaniline

C12H11FN2O — CID 66486737

IUPAC4-(2-aminophenoxy)-3-fluoroaniline
SMILESNc1ccc(Oc2ccccc2N)c(F)c1
InChIInChI=1S/C12H11FN2O/c13-9-7-8(14)5-6-11(9)16-12-4-2-1-3-10(12)15/h1-7H,14-15H2
InChIKeyGYLFNZSZFKLKEI-UHFFFAOYSA-N
MW218.23 g/mol
LogP2.78
Rot. Bonds2

About 4-(2-aminophenoxy)-3-fluoroaniline

4-(2-aminophenoxy)-3-fluoroaniline (PubChem CID 66486737) has the molecular formula C12H11FN2O and a molecular weight of 218.23 g/mol. Its IUPAC name is 4-(2-aminophenoxy)-3-fluoroaniline.

Molecular Properties

Compound Name4-(2-aminophenoxy)-3-fluoroaniline
PubChem CID66486737
Molecular FormulaC12H11FN2O
Molecular Weight218.23 g/mol
Exact Mass218.09
IUPAC Name4-(2-aminophenoxy)-3-fluoroaniline
SMILESNc1ccc(Oc2ccccc2N)c(F)c1
InChIInChI=1S/C12H11FN2O/c13-9-7-8(14)5-6-11(9)16-12-4-2-1-3-10(12)15/h1-7H,14-15H2
InChIKeyGYLFNZSZFKLKEI-UHFFFAOYSA-N
XLogP2.78
TPSA61.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.23
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

4-(2-aminophenoxy)-3-chloroaniline
CID 66486738
2-(4-amino-2-fluorophenoxy)-5-(trifluoromethyl)aniline
CID 66487930
2-[2-[2-(2-aminophenoxy)phenoxy]phenoxy]aniline
CID 22338600
4-(4-aminophenoxy)-3-fluoroaniline
CID 66486728
3-(aminomethyl)-4-(2-fluorophenoxy)aniline
CID 174383451
3-amino-4-(2-fluorophenoxy)phenol
CID 14722258
4-(5-bromo-2-fluorophenoxy)-3-fluoroaniline
CID 114671642
4-(4-amino-2-fluorophenoxy)-3-phenylpyridin-2-amine
CID 169150219
3-fluoro-4-[(3-phenyl-4-pyridinyl)oxy]aniline
CID 89231827
3-fluoro-4-(3-methylquinoxalin-2-yl)oxyaniline
CID 62375219
4-[3-[2,3-bis(2,4-diaminophenoxy)phenoxy]-2-(2,4-diaminophenoxy)phenoxy]benzene-1,3-diamine
CID 174723644
4-(2,4-difluorophenoxy)pyridin-3-amine
CID 28890071

Frequently Asked Questions

What is the IUPAC name of 4-(2-aminophenoxy)-3-fluoroaniline?
The IUPAC name of 4-(2-aminophenoxy)-3-fluoroaniline (CID 66486737) is 4-(2-aminophenoxy)-3-fluoroaniline.
What is the SMILES notation for 4-(2-aminophenoxy)-3-fluoroaniline?
The canonical SMILES for 4-(2-aminophenoxy)-3-fluoroaniline is Nc1ccc(Oc2ccccc2N)c(F)c1.
What is the InChIKey of 4-(2-aminophenoxy)-3-fluoroaniline?
The InChIKey is GYLFNZSZFKLKEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11FN2O/c13-9-7-8(14)5-6-11(9)16-12-4-2-1-3-10(12)15/h1-7H,14-15H2.
What are the key properties of 4-(2-aminophenoxy)-3-fluoroaniline?
4-(2-aminophenoxy)-3-fluoroaniline has a molecular weight of 218.23 g/mol, XLogP of 2.78, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-aminophenoxy)-3-fluoroaniline is sourced from PubChem (CID 66486737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).