2-ethoxy-N-(2-fluoroethyl)aniline

C10H14FNO — CID 80699443

IUPAC2-ethoxy-N-(2-fluoroethyl)aniline
SMILESCCOc1ccccc1NCCF
InChIInChI=1S/C10H14FNO/c1-2-13-10-6-4-3-5-9(10)12-8-7-11/h3-6,12H,2,7-8H2,1H3
InChIKeyUWFZALBNFCBUJG-UHFFFAOYSA-N
MW183.23 g/mol
LogP2.47
Rot. Bonds5

About 2-ethoxy-N-(2-fluoroethyl)aniline

2-ethoxy-N-(2-fluoroethyl)aniline (PubChem CID 80699443) has the molecular formula C10H14FNO and a molecular weight of 183.23 g/mol. Its IUPAC name is 2-ethoxy-N-(2-fluoroethyl)aniline.

Molecular Properties

Compound Name2-ethoxy-N-(2-fluoroethyl)aniline
PubChem CID80699443
Molecular FormulaC10H14FNO
Molecular Weight183.23 g/mol
Exact Mass183.11
IUPAC Name2-ethoxy-N-(2-fluoroethyl)aniline
SMILESCCOc1ccccc1NCCF
InChIInChI=1S/C10H14FNO/c1-2-13-10-6-4-3-5-9(10)12-8-7-11/h3-6,12H,2,7-8H2,1H3
InChIKeyUWFZALBNFCBUJG-UHFFFAOYSA-N
XLogP2.47
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.23
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-(2-fluoroethyl)aniline?
The IUPAC name of 2-ethoxy-N-(2-fluoroethyl)aniline (CID 80699443) is 2-ethoxy-N-(2-fluoroethyl)aniline.
What is the SMILES notation for 2-ethoxy-N-(2-fluoroethyl)aniline?
The canonical SMILES for 2-ethoxy-N-(2-fluoroethyl)aniline is CCOc1ccccc1NCCF.
What is the InChIKey of 2-ethoxy-N-(2-fluoroethyl)aniline?
The InChIKey is UWFZALBNFCBUJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FNO/c1-2-13-10-6-4-3-5-9(10)12-8-7-11/h3-6,12H,2,7-8H2,1H3.
What are the key properties of 2-ethoxy-N-(2-fluoroethyl)aniline?
2-ethoxy-N-(2-fluoroethyl)aniline has a molecular weight of 183.23 g/mol, XLogP of 2.47, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-(2-fluoroethyl)aniline is sourced from PubChem (CID 80699443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).