3-(2-chloropyrimidin-4-yl)-2-phenylpyrazolo[1,5-a]pyridine

C17H11ClN4 — CID 15158143

IUPAC3-(2-chloropyrimidin-4-yl)-2-phenylpyrazolo[1,5-a]pyridine
SMILESClc1nccc(-c2c(-c3ccccc3)nn3ccccc23)n1
InChIInChI=1S/C17H11ClN4/c18-17-19-10-9-13(20-17)15-14-8-4-5-11-22(14)21-16(15)12-6-2-1-3-7-12/h1-11H
InChIKeyRPVCHWPFZYRZTR-UHFFFAOYSA-N
MW306.76 g/mol
LogP4.11
Rot. Bonds2

About 3-(2-chloropyrimidin-4-yl)-2-phenylpyrazolo[1,5-a]pyridine

3-(2-chloropyrimidin-4-yl)-2-phenylpyrazolo[1,5-a]pyridine (PubChem CID 15158143) has the molecular formula C17H11ClN4 and a molecular weight of 306.76 g/mol. Its IUPAC name is 3-(2-chloropyrimidin-4-yl)-2-phenylpyrazolo[1,5-a]pyridine.

Molecular Properties

Compound Name3-(2-chloropyrimidin-4-yl)-2-phenylpyrazolo[1,5-a]pyridine
PubChem CID15158143
Molecular FormulaC17H11ClN4
Molecular Weight306.76 g/mol
Exact Mass306.07
IUPAC Name3-(2-chloropyrimidin-4-yl)-2-phenylpyrazolo[1,5-a]pyridine
SMILESClc1nccc(-c2c(-c3ccccc3)nn3ccccc23)n1
InChIInChI=1S/C17H11ClN4/c18-17-19-10-9-13(20-17)15-14-8-4-5-11-22(14)21-16(15)12-6-2-1-3-7-12/h1-11H
InChIKeyRPVCHWPFZYRZTR-UHFFFAOYSA-N
XLogP4.11
TPSA43.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.76
LogP ≤ 54.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(2-chloropyrimidin-4-yl)-2-phenylpyrazolo[1,5-a]pyridine?
The IUPAC name of 3-(2-chloropyrimidin-4-yl)-2-phenylpyrazolo[1,5-a]pyridine (CID 15158143) is 3-(2-chloropyrimidin-4-yl)-2-phenylpyrazolo[1,5-a]pyridine.
What is the SMILES notation for 3-(2-chloropyrimidin-4-yl)-2-phenylpyrazolo[1,5-a]pyridine?
The canonical SMILES for 3-(2-chloropyrimidin-4-yl)-2-phenylpyrazolo[1,5-a]pyridine is Clc1nccc(-c2c(-c3ccccc3)nn3ccccc23)n1.
What is the InChIKey of 3-(2-chloropyrimidin-4-yl)-2-phenylpyrazolo[1,5-a]pyridine?
The InChIKey is RPVCHWPFZYRZTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11ClN4/c18-17-19-10-9-13(20-17)15-14-8-4-5-11-22(14)21-16(15)12-6-2-1-3-7-12/h1-11H.
What are the key properties of 3-(2-chloropyrimidin-4-yl)-2-phenylpyrazolo[1,5-a]pyridine?
3-(2-chloropyrimidin-4-yl)-2-phenylpyrazolo[1,5-a]pyridine has a molecular weight of 306.76 g/mol, XLogP of 4.11, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-chloropyrimidin-4-yl)-2-phenylpyrazolo[1,5-a]pyridine is sourced from PubChem (CID 15158143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).