5-(3-fluoro-4-pyridinyl)-4-pyridin-2-yl-1H-pyrazol-3-amine

C13H10FN5 — CID 80521210

IUPAC5-(3-fluoro-4-pyridinyl)-4-pyridin-2-yl-1H-pyrazol-3-amine
SMILESNc1n[nH]c(-c2ccncc2F)c1-c1ccccn1
InChIInChI=1S/C13H10FN5/c14-9-7-16-6-4-8(9)12-11(13(15)19-18-12)10-3-1-2-5-17-10/h1-7H,(H3,15,18,19)
InChIKeyUMRASRVTLWGOEH-UHFFFAOYSA-N
MW255.26 g/mol
LogP2.26
Rot. Bonds2

About 5-(3-fluoro-4-pyridinyl)-4-pyridin-2-yl-1H-pyrazol-3-amine

5-(3-fluoro-4-pyridinyl)-4-pyridin-2-yl-1H-pyrazol-3-amine (PubChem CID 80521210) has the molecular formula C13H10FN5 and a molecular weight of 255.26 g/mol. Its IUPAC name is 5-(3-fluoro-4-pyridinyl)-4-pyridin-2-yl-1H-pyrazol-3-amine.

Molecular Properties

Compound Name5-(3-fluoro-4-pyridinyl)-4-pyridin-2-yl-1H-pyrazol-3-amine
PubChem CID80521210
Molecular FormulaC13H10FN5
Molecular Weight255.26 g/mol
Exact Mass255.09
IUPAC Name5-(3-fluoro-4-pyridinyl)-4-pyridin-2-yl-1H-pyrazol-3-amine
SMILESNc1n[nH]c(-c2ccncc2F)c1-c1ccccn1
InChIInChI=1S/C13H10FN5/c14-9-7-16-6-4-8(9)12-11(13(15)19-18-12)10-3-1-2-5-17-10/h1-7H,(H3,15,18,19)
InChIKeyUMRASRVTLWGOEH-UHFFFAOYSA-N
XLogP2.26
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.26
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(3-fluoro-4-pyridinyl)-4-pyridin-2-yl-1H-pyrazol-3-amine?
The IUPAC name of 5-(3-fluoro-4-pyridinyl)-4-pyridin-2-yl-1H-pyrazol-3-amine (CID 80521210) is 5-(3-fluoro-4-pyridinyl)-4-pyridin-2-yl-1H-pyrazol-3-amine.
What is the SMILES notation for 5-(3-fluoro-4-pyridinyl)-4-pyridin-2-yl-1H-pyrazol-3-amine?
The canonical SMILES for 5-(3-fluoro-4-pyridinyl)-4-pyridin-2-yl-1H-pyrazol-3-amine is Nc1n[nH]c(-c2ccncc2F)c1-c1ccccn1.
What is the InChIKey of 5-(3-fluoro-4-pyridinyl)-4-pyridin-2-yl-1H-pyrazol-3-amine?
The InChIKey is UMRASRVTLWGOEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10FN5/c14-9-7-16-6-4-8(9)12-11(13(15)19-18-12)10-3-1-2-5-17-10/h1-7H,(H3,15,18,19).
What are the key properties of 5-(3-fluoro-4-pyridinyl)-4-pyridin-2-yl-1H-pyrazol-3-amine?
5-(3-fluoro-4-pyridinyl)-4-pyridin-2-yl-1H-pyrazol-3-amine has a molecular weight of 255.26 g/mol, XLogP of 2.26, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-fluoro-4-pyridinyl)-4-pyridin-2-yl-1H-pyrazol-3-amine is sourced from PubChem (CID 80521210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).