N-[2-[2-(3-fluorophenyl)phenyl]ethyl]piperidin-4-amine

C19H23FN2 — CID 67173045

IUPACN-[2-[2-(3-fluorophenyl)phenyl]ethyl]piperidin-4-amine
SMILESFc1cccc(-c2ccccc2CCNC2CCNCC2)c1
InChIInChI=1S/C19H23FN2/c20-17-6-3-5-16(14-17)19-7-2-1-4-15(19)8-13-22-18-9-11-21-12-10-18/h1-7,14,18,21-22H,8-13H2
InChIKeyTZMZTPYZATZEMD-UHFFFAOYSA-N
MW298.41 g/mol
LogP3.38
Rot. Bonds5

About N-[2-[2-(3-fluorophenyl)phenyl]ethyl]piperidin-4-amine

N-[2-[2-(3-fluorophenyl)phenyl]ethyl]piperidin-4-amine (PubChem CID 67173045) has the molecular formula C19H23FN2 and a molecular weight of 298.41 g/mol. Its IUPAC name is N-[2-[2-(3-fluorophenyl)phenyl]ethyl]piperidin-4-amine.

Molecular Properties

Compound NameN-[2-[2-(3-fluorophenyl)phenyl]ethyl]piperidin-4-amine
PubChem CID67173045
Molecular FormulaC19H23FN2
Molecular Weight298.41 g/mol
Exact Mass298.18
IUPAC NameN-[2-[2-(3-fluorophenyl)phenyl]ethyl]piperidin-4-amine
SMILESFc1cccc(-c2ccccc2CCNC2CCNCC2)c1
InChIInChI=1S/C19H23FN2/c20-17-6-3-5-16(14-17)19-7-2-1-4-15(19)8-13-22-18-9-11-21-12-10-18/h1-7,14,18,21-22H,8-13H2
InChIKeyTZMZTPYZATZEMD-UHFFFAOYSA-N
XLogP3.38
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.41
LogP ≤ 53.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(3-fluorophenyl)phenyl]ethyl]piperidin-4-amine?
The IUPAC name of N-[2-[2-(3-fluorophenyl)phenyl]ethyl]piperidin-4-amine (CID 67173045) is N-[2-[2-(3-fluorophenyl)phenyl]ethyl]piperidin-4-amine.
What is the SMILES notation for N-[2-[2-(3-fluorophenyl)phenyl]ethyl]piperidin-4-amine?
The canonical SMILES for N-[2-[2-(3-fluorophenyl)phenyl]ethyl]piperidin-4-amine is Fc1cccc(-c2ccccc2CCNC2CCNCC2)c1.
What is the InChIKey of N-[2-[2-(3-fluorophenyl)phenyl]ethyl]piperidin-4-amine?
The InChIKey is TZMZTPYZATZEMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23FN2/c20-17-6-3-5-16(14-17)19-7-2-1-4-15(19)8-13-22-18-9-11-21-12-10-18/h1-7,14,18,21-22H,8-13H2.
What are the key properties of N-[2-[2-(3-fluorophenyl)phenyl]ethyl]piperidin-4-amine?
N-[2-[2-(3-fluorophenyl)phenyl]ethyl]piperidin-4-amine has a molecular weight of 298.41 g/mol, XLogP of 3.38, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(3-fluorophenyl)phenyl]ethyl]piperidin-4-amine is sourced from PubChem (CID 67173045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).