6-(4-chloropyrazol-1-yl)pyridin-3-amine

C8H7ClN4 — CID 19627824

IUPAC6-(4-chloropyrazol-1-yl)pyridin-3-amine
SMILESNc1ccc(-n2cc(Cl)cn2)nc1
InChIInChI=1S/C8H7ClN4/c9-6-3-12-13(5-6)8-2-1-7(10)4-11-8/h1-5H,10H2
InChIKeyQGRNBBMYIYYTPB-UHFFFAOYSA-N
MW194.63 g/mol
LogP1.50
Rot. Bonds1

About 6-(4-chloropyrazol-1-yl)pyridin-3-amine

6-(4-chloropyrazol-1-yl)pyridin-3-amine (PubChem CID 19627824) has the molecular formula C8H7ClN4 and a molecular weight of 194.63 g/mol. Its IUPAC name is 6-(4-chloropyrazol-1-yl)pyridin-3-amine.

Molecular Properties

Compound Name6-(4-chloropyrazol-1-yl)pyridin-3-amine
PubChem CID19627824
Molecular FormulaC8H7ClN4
Molecular Weight194.63 g/mol
Exact Mass194.04
IUPAC Name6-(4-chloropyrazol-1-yl)pyridin-3-amine
SMILESNc1ccc(-n2cc(Cl)cn2)nc1
InChIInChI=1S/C8H7ClN4/c9-6-3-12-13(5-6)8-2-1-7(10)4-11-8/h1-5H,10H2
InChIKeyQGRNBBMYIYYTPB-UHFFFAOYSA-N
XLogP1.50
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.63
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(4-chloropyrazol-1-yl)pyridin-3-amine?
The IUPAC name of 6-(4-chloropyrazol-1-yl)pyridin-3-amine (CID 19627824) is 6-(4-chloropyrazol-1-yl)pyridin-3-amine.
What is the SMILES notation for 6-(4-chloropyrazol-1-yl)pyridin-3-amine?
The canonical SMILES for 6-(4-chloropyrazol-1-yl)pyridin-3-amine is Nc1ccc(-n2cc(Cl)cn2)nc1.
What is the InChIKey of 6-(4-chloropyrazol-1-yl)pyridin-3-amine?
The InChIKey is QGRNBBMYIYYTPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7ClN4/c9-6-3-12-13(5-6)8-2-1-7(10)4-11-8/h1-5H,10H2.
What are the key properties of 6-(4-chloropyrazol-1-yl)pyridin-3-amine?
6-(4-chloropyrazol-1-yl)pyridin-3-amine has a molecular weight of 194.63 g/mol, XLogP of 1.50, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-chloropyrazol-1-yl)pyridin-3-amine is sourced from PubChem (CID 19627824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).