4-(4,5-dihydro-1H-pyrazol-3-yl)pyridine

C8H9N3 — CID 13126034

IUPAC4-(4,5-dihydro-1H-pyrazol-3-yl)pyridine
SMILESc1cc(C2=NNCC2)ccn1
InChIInChI=1S/C8H9N3/c1-4-9-5-2-7(1)8-3-6-10-11-8/h1-2,4-5,10H,3,6H2
InChIKeyVBGSXZOGPMAFDK-UHFFFAOYSA-N
MW147.18 g/mol
LogP0.78
Rot. Bonds1

About 4-(4,5-dihydro-1H-pyrazol-3-yl)pyridine

4-(4,5-dihydro-1H-pyrazol-3-yl)pyridine (PubChem CID 13126034) has the molecular formula C8H9N3 and a molecular weight of 147.18 g/mol. Its IUPAC name is 4-(4,5-dihydro-1H-pyrazol-3-yl)pyridine.

Molecular Properties

Compound Name4-(4,5-dihydro-1H-pyrazol-3-yl)pyridine
PubChem CID13126034
Molecular FormulaC8H9N3
Molecular Weight147.18 g/mol
Exact Mass147.08
IUPAC Name4-(4,5-dihydro-1H-pyrazol-3-yl)pyridine
SMILESc1cc(C2=NNCC2)ccn1
InChIInChI=1S/C8H9N3/c1-4-9-5-2-7(1)8-3-6-10-11-8/h1-2,4-5,10H,3,6H2
InChIKeyVBGSXZOGPMAFDK-UHFFFAOYSA-N
XLogP0.78
TPSA37.28 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.18
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(4,5-dihydro-1H-pyrazol-3-yl)pyridine?
The IUPAC name of 4-(4,5-dihydro-1H-pyrazol-3-yl)pyridine (CID 13126034) is 4-(4,5-dihydro-1H-pyrazol-3-yl)pyridine.
What is the SMILES notation for 4-(4,5-dihydro-1H-pyrazol-3-yl)pyridine?
The canonical SMILES for 4-(4,5-dihydro-1H-pyrazol-3-yl)pyridine is c1cc(C2=NNCC2)ccn1.
What is the InChIKey of 4-(4,5-dihydro-1H-pyrazol-3-yl)pyridine?
The InChIKey is VBGSXZOGPMAFDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3/c1-4-9-5-2-7(1)8-3-6-10-11-8/h1-2,4-5,10H,3,6H2.
What are the key properties of 4-(4,5-dihydro-1H-pyrazol-3-yl)pyridine?
4-(4,5-dihydro-1H-pyrazol-3-yl)pyridine has a molecular weight of 147.18 g/mol, XLogP of 0.78, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4,5-dihydro-1H-pyrazol-3-yl)pyridine is sourced from PubChem (CID 13126034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).