3-pyrazol-1-ylpyridin-4-amine

C8H8N4 — CID 82415566

IUPAC3-pyrazol-1-ylpyridin-4-amine
SMILESNc1ccncc1-n1cccn1
InChIInChI=1S/C8H8N4/c9-7-2-4-10-6-8(7)12-5-1-3-11-12/h1-6H,(H2,9,10)
InChIKeyPSMWEWJBZXBKJY-UHFFFAOYSA-N
MW160.18 g/mol
LogP0.85
Rot. Bonds1

About 3-pyrazol-1-ylpyridin-4-amine

3-pyrazol-1-ylpyridin-4-amine (PubChem CID 82415566) has the molecular formula C8H8N4 and a molecular weight of 160.18 g/mol. Its IUPAC name is 3-pyrazol-1-ylpyridin-4-amine.

Molecular Properties

Compound Name3-pyrazol-1-ylpyridin-4-amine
PubChem CID82415566
Molecular FormulaC8H8N4
Molecular Weight160.18 g/mol
Exact Mass160.07
IUPAC Name3-pyrazol-1-ylpyridin-4-amine
SMILESNc1ccncc1-n1cccn1
InChIInChI=1S/C8H8N4/c9-7-2-4-10-6-8(7)12-5-1-3-11-12/h1-6H,(H2,9,10)
InChIKeyPSMWEWJBZXBKJY-UHFFFAOYSA-N
XLogP0.85
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.18
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-pyrazol-1-ylpyridin-4-amine?
The IUPAC name of 3-pyrazol-1-ylpyridin-4-amine (CID 82415566) is 3-pyrazol-1-ylpyridin-4-amine.
What is the SMILES notation for 3-pyrazol-1-ylpyridin-4-amine?
The canonical SMILES for 3-pyrazol-1-ylpyridin-4-amine is Nc1ccncc1-n1cccn1.
What is the InChIKey of 3-pyrazol-1-ylpyridin-4-amine?
The InChIKey is PSMWEWJBZXBKJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N4/c9-7-2-4-10-6-8(7)12-5-1-3-11-12/h1-6H,(H2,9,10).
What are the key properties of 3-pyrazol-1-ylpyridin-4-amine?
3-pyrazol-1-ylpyridin-4-amine has a molecular weight of 160.18 g/mol, XLogP of 0.85, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyrazol-1-ylpyridin-4-amine is sourced from PubChem (CID 82415566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).