1-(3-fluoro-2-pyridinyl)-4-phenylpiperazine

C15H16FN3 — CID 171328537

IUPAC1-(3-fluoro-2-pyridinyl)-4-phenylpiperazine
SMILESFc1cccnc1N1CCN(c2ccccc2)CC1
InChIInChI=1S/C15H16FN3/c16-14-7-4-8-17-15(14)19-11-9-18(10-12-19)13-5-2-1-3-6-13/h1-8H,9-12H2
InChIKeyIJRFXBWKGBDHBC-UHFFFAOYSA-N
MW257.31 g/mol
LogP2.55
Rot. Bonds2

About 1-(3-fluoro-2-pyridinyl)-4-phenylpiperazine

1-(3-fluoro-2-pyridinyl)-4-phenylpiperazine (PubChem CID 171328537) has the molecular formula C15H16FN3 and a molecular weight of 257.31 g/mol. Its IUPAC name is 1-(3-fluoro-2-pyridinyl)-4-phenylpiperazine.

Molecular Properties

Compound Name1-(3-fluoro-2-pyridinyl)-4-phenylpiperazine
PubChem CID171328537
Molecular FormulaC15H16FN3
Molecular Weight257.31 g/mol
Exact Mass257.13
IUPAC Name1-(3-fluoro-2-pyridinyl)-4-phenylpiperazine
SMILESFc1cccnc1N1CCN(c2ccccc2)CC1
InChIInChI=1S/C15H16FN3/c16-14-7-4-8-17-15(14)19-11-9-18(10-12-19)13-5-2-1-3-6-13/h1-8H,9-12H2
InChIKeyIJRFXBWKGBDHBC-UHFFFAOYSA-N
XLogP2.55
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.31
LogP ≤ 52.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoro-2-pyridinyl)-4-phenylpiperazine?
The IUPAC name of 1-(3-fluoro-2-pyridinyl)-4-phenylpiperazine (CID 171328537) is 1-(3-fluoro-2-pyridinyl)-4-phenylpiperazine.
What is the SMILES notation for 1-(3-fluoro-2-pyridinyl)-4-phenylpiperazine?
The canonical SMILES for 1-(3-fluoro-2-pyridinyl)-4-phenylpiperazine is Fc1cccnc1N1CCN(c2ccccc2)CC1.
What is the InChIKey of 1-(3-fluoro-2-pyridinyl)-4-phenylpiperazine?
The InChIKey is IJRFXBWKGBDHBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FN3/c16-14-7-4-8-17-15(14)19-11-9-18(10-12-19)13-5-2-1-3-6-13/h1-8H,9-12H2.
What are the key properties of 1-(3-fluoro-2-pyridinyl)-4-phenylpiperazine?
1-(3-fluoro-2-pyridinyl)-4-phenylpiperazine has a molecular weight of 257.31 g/mol, XLogP of 2.55, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluoro-2-pyridinyl)-4-phenylpiperazine is sourced from PubChem (CID 171328537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).