3-(4-pyridin-4-yl-1H-pyrazol-5-yl)pyridine

C13H10N4 — CID 3321413

IUPAC3-(4-pyridin-4-yl-1H-pyrazol-5-yl)pyridine
SMILESc1cncc(-c2[nH]ncc2-c2ccncc2)c1
InChIInChI=1S/C13H10N4/c1-2-11(8-15-5-1)13-12(9-16-17-13)10-3-6-14-7-4-10/h1-9H,(H,16,17)
InChIKeyXBRFXAAQOXJWCI-UHFFFAOYSA-N
MW222.25 g/mol
LogP2.53
Rot. Bonds2

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

3-(4-pyridin-4-yl-1H-pyrazol-5-yl)pyridine (PubChem CID 3321413) has the molecular formula C13H10N4 and a molecular weight of 222.25 g/mol. Its IUPAC name is 3-(4-pyridin-4-yl-1H-pyrazol-5-yl)pyridine.

Molecular Properties

Compound Name3-(4-pyridin-4-yl-1H-pyrazol-5-yl)pyridine
PubChem CID3321413
Molecular FormulaC13H10N4
Molecular Weight222.25 g/mol
Exact Mass222.09
IUPAC Name3-(4-pyridin-4-yl-1H-pyrazol-5-yl)pyridine
SMILESc1cncc(-c2[nH]ncc2-c2ccncc2)c1
InChIInChI=1S/C13H10N4/c1-2-11(8-15-5-1)13-12(9-16-17-13)10-3-6-14-7-4-10/h1-9H,(H,16,17)
InChIKeyXBRFXAAQOXJWCI-UHFFFAOYSA-N
XLogP2.53
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.25
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[5-(3-fluorophenyl)-1H-pyrazol-4-yl]pyridine
CID 22037203
4-[4-(4-chlorophenyl)-1H-pyrazol-5-yl]pyridine
CID 160851614
(5-pyridin-3-yl-1H-pyrazol-4-yl)methanol
CID 43753528
ethane;4-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]pyridine
CID 143047131
4-(5-pyridin-3-yl-1H-pyrazol-4-yl)pyrimidin-2-amine
CID 153277392
5-(4-pyridin-4-yl-1H-pyrazol-5-yl)-2-(trifluoromethyl)pyridine
CID 3694575
2-(5-pyridin-4-yl-1H-pyrazol-4-yl)phenol
CID 135677555
4-(4-pyridin-4-yl-1H-pyrazol-5-yl)benzenesulfonamide
CID 19355817
4-[5-(5-bromothiophen-2-yl)-1H-pyrazol-4-yl]pyridine
CID 67260424
3-[4-(5-pyridin-4-yl-1H-pyrazol-4-yl)phenyl]benzenesulfonamide
CID 166490570
4,5-diphenyl-1H-pyrazole;ethane;molecular hydrogen
CID 144664765
1-methyl-3-[3-(4-pyridin-4-yl-1H-pyrazol-5-yl)phenyl]urea
CID 67185993

Frequently Asked Questions

What is the IUPAC name of 3-(4-pyridin-4-yl-1H-pyrazol-5-yl)pyridine?
The IUPAC name of 3-(4-pyridin-4-yl-1H-pyrazol-5-yl)pyridine (CID 3321413) is 3-(4-pyridin-4-yl-1H-pyrazol-5-yl)pyridine.
What is the SMILES notation for 3-(4-pyridin-4-yl-1H-pyrazol-5-yl)pyridine?
The canonical SMILES for 3-(4-pyridin-4-yl-1H-pyrazol-5-yl)pyridine is c1cncc(-c2[nH]ncc2-c2ccncc2)c1.
What is the InChIKey of 3-(4-pyridin-4-yl-1H-pyrazol-5-yl)pyridine?
The InChIKey is XBRFXAAQOXJWCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N4/c1-2-11(8-15-5-1)13-12(9-16-17-13)10-3-6-14-7-4-10/h1-9H,(H,16,17).
What are the key properties of 3-(4-pyridin-4-yl-1H-pyrazol-5-yl)pyridine?
3-(4-pyridin-4-yl-1H-pyrazol-5-yl)pyridine has a molecular weight of 222.25 g/mol, XLogP of 2.53, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-pyridin-4-yl-1H-pyrazol-5-yl)pyridine is sourced from PubChem (CID 3321413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).