5-[1-(5-fluoro-3-pyridinyl)piperidin-4-yl]-1H-pyrazol-3-amine

C13H16FN5 — CID 141401616

IUPAC5-[1-(5-fluoro-3-pyridinyl)piperidin-4-yl]-1H-pyrazol-3-amine
SMILESNc1cc(C2CCN(c3cncc(F)c3)CC2)[nH]n1
InChIInChI=1S/C13H16FN5/c14-10-5-11(8-16-7-10)19-3-1-9(2-4-19)12-6-13(15)18-17-12/h5-9H,1-4H2,(H3,15,17,18)
InChIKeyQFHHFACRYYADPD-UHFFFAOYSA-N
MW261.30 g/mol
LogP1.91
Rot. Bonds2

About 5-[1-(5-fluoro-3-pyridinyl)piperidin-4-yl]-1H-pyrazol-3-amine

5-[1-(5-fluoro-3-pyridinyl)piperidin-4-yl]-1H-pyrazol-3-amine (PubChem CID 141401616) has the molecular formula C13H16FN5 and a molecular weight of 261.30 g/mol. Its IUPAC name is 5-[1-(5-fluoro-3-pyridinyl)piperidin-4-yl]-1H-pyrazol-3-amine.

Molecular Properties

Compound Name5-[1-(5-fluoro-3-pyridinyl)piperidin-4-yl]-1H-pyrazol-3-amine
PubChem CID141401616
Molecular FormulaC13H16FN5
Molecular Weight261.30 g/mol
Exact Mass261.14
IUPAC Name5-[1-(5-fluoro-3-pyridinyl)piperidin-4-yl]-1H-pyrazol-3-amine
SMILESNc1cc(C2CCN(c3cncc(F)c3)CC2)[nH]n1
InChIInChI=1S/C13H16FN5/c14-10-5-11(8-16-7-10)19-3-1-9(2-4-19)12-6-13(15)18-17-12/h5-9H,1-4H2,(H3,15,17,18)
InChIKeyQFHHFACRYYADPD-UHFFFAOYSA-N
XLogP1.91
TPSA70.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.30
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-[1-(5-fluoro-3-pyridinyl)piperidin-4-yl]-1H-pyrazol-3-amine?
The IUPAC name of 5-[1-(5-fluoro-3-pyridinyl)piperidin-4-yl]-1H-pyrazol-3-amine (CID 141401616) is 5-[1-(5-fluoro-3-pyridinyl)piperidin-4-yl]-1H-pyrazol-3-amine.
What is the SMILES notation for 5-[1-(5-fluoro-3-pyridinyl)piperidin-4-yl]-1H-pyrazol-3-amine?
The canonical SMILES for 5-[1-(5-fluoro-3-pyridinyl)piperidin-4-yl]-1H-pyrazol-3-amine is Nc1cc(C2CCN(c3cncc(F)c3)CC2)[nH]n1.
What is the InChIKey of 5-[1-(5-fluoro-3-pyridinyl)piperidin-4-yl]-1H-pyrazol-3-amine?
The InChIKey is QFHHFACRYYADPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16FN5/c14-10-5-11(8-16-7-10)19-3-1-9(2-4-19)12-6-13(15)18-17-12/h5-9H,1-4H2,(H3,15,17,18).
What are the key properties of 5-[1-(5-fluoro-3-pyridinyl)piperidin-4-yl]-1H-pyrazol-3-amine?
5-[1-(5-fluoro-3-pyridinyl)piperidin-4-yl]-1H-pyrazol-3-amine has a molecular weight of 261.30 g/mol, XLogP of 1.91, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-(5-fluoro-3-pyridinyl)piperidin-4-yl]-1H-pyrazol-3-amine is sourced from PubChem (CID 141401616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).