4-ethyl-N-[1-(4-fluorophenyl)pentyl]aniline

C19H24FN — CID 43097077

IUPAC4-ethyl-N-[1-(4-fluorophenyl)pentyl]aniline
SMILESCCCCC(Nc1ccc(CC)cc1)c1ccc(F)cc1
InChIInChI=1S/C19H24FN/c1-3-5-6-19(16-9-11-17(20)12-10-16)21-18-13-7-15(4-2)8-14-18/h7-14,19,21H,3-6H2,1-2H3
InChIKeyQIFYSUBLZKROLA-UHFFFAOYSA-N
MW285.41 g/mol
LogP5.73
Rot. Bonds7

About 4-ethyl-N-[1-(4-fluorophenyl)pentyl]aniline

4-ethyl-N-[1-(4-fluorophenyl)pentyl]aniline (PubChem CID 43097077) has the molecular formula C19H24FN and a molecular weight of 285.41 g/mol. Its IUPAC name is 4-ethyl-N-[1-(4-fluorophenyl)pentyl]aniline.

Molecular Properties

Compound Name4-ethyl-N-[1-(4-fluorophenyl)pentyl]aniline
PubChem CID43097077
Molecular FormulaC19H24FN
Molecular Weight285.41 g/mol
Exact Mass285.19
IUPAC Name4-ethyl-N-[1-(4-fluorophenyl)pentyl]aniline
SMILESCCCCC(Nc1ccc(CC)cc1)c1ccc(F)cc1
InChIInChI=1S/C19H24FN/c1-3-5-6-19(16-9-11-17(20)12-10-16)21-18-13-7-15(4-2)8-14-18/h7-14,19,21H,3-6H2,1-2H3
InChIKeyQIFYSUBLZKROLA-UHFFFAOYSA-N
XLogP5.73
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500285.41
LogP ≤ 55.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 4-ethyl-N-[1-(4-fluorophenyl)pentyl]aniline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-[1-(4-fluorophenyl)pentyl]aniline?
The IUPAC name of 4-ethyl-N-[1-(4-fluorophenyl)pentyl]aniline (CID 43097077) is 4-ethyl-N-[1-(4-fluorophenyl)pentyl]aniline.
What is the SMILES notation for 4-ethyl-N-[1-(4-fluorophenyl)pentyl]aniline?
The canonical SMILES for 4-ethyl-N-[1-(4-fluorophenyl)pentyl]aniline is CCCCC(Nc1ccc(CC)cc1)c1ccc(F)cc1.
What is the InChIKey of 4-ethyl-N-[1-(4-fluorophenyl)pentyl]aniline?
The InChIKey is QIFYSUBLZKROLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24FN/c1-3-5-6-19(16-9-11-17(20)12-10-16)21-18-13-7-15(4-2)8-14-18/h7-14,19,21H,3-6H2,1-2H3.
What are the key properties of 4-ethyl-N-[1-(4-fluorophenyl)pentyl]aniline?
4-ethyl-N-[1-(4-fluorophenyl)pentyl]aniline has a molecular weight of 285.41 g/mol, XLogP of 5.73, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-[1-(4-fluorophenyl)pentyl]aniline is sourced from PubChem (CID 43097077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).