4-(2-thiophen-2-ylpyrazolo[1,5-a]pyridin-3-yl)quinoline

C20H13N3S — CID 69221248

IUPAC4-(2-thiophen-2-ylpyrazolo[1,5-a]pyridin-3-yl)quinoline
SMILESc1csc(-c2nn3ccccc3c2-c2ccnc3ccccc23)c1
InChIInChI=1S/C20H13N3S/c1-2-7-16-14(6-1)15(10-11-21-16)19-17-8-3-4-12-23(17)22-20(19)18-9-5-13-24-18/h1-13H
InChIKeyQDWMBAYFISLLTM-UHFFFAOYSA-N
MW327.41 g/mol
LogP5.28
Rot. Bonds2

About 4-(2-thiophen-2-ylpyrazolo[1,5-a]pyridin-3-yl)quinoline

4-(2-thiophen-2-ylpyrazolo[1,5-a]pyridin-3-yl)quinoline (PubChem CID 69221248) has the molecular formula C20H13N3S and a molecular weight of 327.41 g/mol. Its IUPAC name is 4-(2-thiophen-2-ylpyrazolo[1,5-a]pyridin-3-yl)quinoline.

Molecular Properties

Compound Name4-(2-thiophen-2-ylpyrazolo[1,5-a]pyridin-3-yl)quinoline
PubChem CID69221248
Molecular FormulaC20H13N3S
Molecular Weight327.41 g/mol
Exact Mass327.08
IUPAC Name4-(2-thiophen-2-ylpyrazolo[1,5-a]pyridin-3-yl)quinoline
SMILESc1csc(-c2nn3ccccc3c2-c2ccnc3ccccc23)c1
InChIInChI=1S/C20H13N3S/c1-2-7-16-14(6-1)15(10-11-21-16)19-17-8-3-4-12-23(17)22-20(19)18-9-5-13-24-18/h1-13H
InChIKeyQDWMBAYFISLLTM-UHFFFAOYSA-N
XLogP5.28
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500327.41
LogP ≤ 55.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(2-thiophen-2-ylpyrazolo[1,5-a]pyridin-3-yl)quinoline?
The IUPAC name of 4-(2-thiophen-2-ylpyrazolo[1,5-a]pyridin-3-yl)quinoline (CID 69221248) is 4-(2-thiophen-2-ylpyrazolo[1,5-a]pyridin-3-yl)quinoline.
What is the SMILES notation for 4-(2-thiophen-2-ylpyrazolo[1,5-a]pyridin-3-yl)quinoline?
The canonical SMILES for 4-(2-thiophen-2-ylpyrazolo[1,5-a]pyridin-3-yl)quinoline is c1csc(-c2nn3ccccc3c2-c2ccnc3ccccc23)c1.
What is the InChIKey of 4-(2-thiophen-2-ylpyrazolo[1,5-a]pyridin-3-yl)quinoline?
The InChIKey is QDWMBAYFISLLTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H13N3S/c1-2-7-16-14(6-1)15(10-11-21-16)19-17-8-3-4-12-23(17)22-20(19)18-9-5-13-24-18/h1-13H.
What are the key properties of 4-(2-thiophen-2-ylpyrazolo[1,5-a]pyridin-3-yl)quinoline?
4-(2-thiophen-2-ylpyrazolo[1,5-a]pyridin-3-yl)quinoline has a molecular weight of 327.41 g/mol, XLogP of 5.28, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-thiophen-2-ylpyrazolo[1,5-a]pyridin-3-yl)quinoline is sourced from PubChem (CID 69221248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).