5-(1-methylpyrazolo[5,4-b]pyridin-6-yl)-2-pyridin-3-yl-1,3-thiazole

C15H11N5S — CID 123365126

IUPAC5-(1-methylpyrazolo[5,4-b]pyridin-6-yl)-2-pyridin-3-yl-1,3-thiazole
SMILESCn1ncc2ccc(-c3cnc(-c4cccnc4)s3)nc21
InChIInChI=1S/C15H11N5S/c1-20-14-10(8-18-20)4-5-12(19-14)13-9-17-15(21-13)11-3-2-6-16-7-11/h2-9H,1H3
InChIKeyFVFQEYVYJHVXTE-UHFFFAOYSA-N
MW293.36 g/mol
LogP3.15
Rot. Bonds2

About 5-(1-methylpyrazolo[5,4-b]pyridin-6-yl)-2-pyridin-3-yl-1,3-thiazole

5-(1-methylpyrazolo[5,4-b]pyridin-6-yl)-2-pyridin-3-yl-1,3-thiazole (PubChem CID 123365126) has the molecular formula C15H11N5S and a molecular weight of 293.36 g/mol. Its IUPAC name is 5-(1-methylpyrazolo[5,4-b]pyridin-6-yl)-2-pyridin-3-yl-1,3-thiazole.

Molecular Properties

Compound Name5-(1-methylpyrazolo[5,4-b]pyridin-6-yl)-2-pyridin-3-yl-1,3-thiazole
PubChem CID123365126
Molecular FormulaC15H11N5S
Molecular Weight293.36 g/mol
Exact Mass293.07
IUPAC Name5-(1-methylpyrazolo[5,4-b]pyridin-6-yl)-2-pyridin-3-yl-1,3-thiazole
SMILESCn1ncc2ccc(-c3cnc(-c4cccnc4)s3)nc21
InChIInChI=1S/C15H11N5S/c1-20-14-10(8-18-20)4-5-12(19-14)13-9-17-15(21-13)11-3-2-6-16-7-11/h2-9H,1H3
InChIKeyFVFQEYVYJHVXTE-UHFFFAOYSA-N
XLogP3.15
TPSA56.49 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.36
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-(1-methylpyrazolo[5,4-b]pyridin-6-yl)-2-pyridin-3-yl-1,3-thiazole?
The IUPAC name of 5-(1-methylpyrazolo[5,4-b]pyridin-6-yl)-2-pyridin-3-yl-1,3-thiazole (CID 123365126) is 5-(1-methylpyrazolo[5,4-b]pyridin-6-yl)-2-pyridin-3-yl-1,3-thiazole.
What is the SMILES notation for 5-(1-methylpyrazolo[5,4-b]pyridin-6-yl)-2-pyridin-3-yl-1,3-thiazole?
The canonical SMILES for 5-(1-methylpyrazolo[5,4-b]pyridin-6-yl)-2-pyridin-3-yl-1,3-thiazole is Cn1ncc2ccc(-c3cnc(-c4cccnc4)s3)nc21.
What is the InChIKey of 5-(1-methylpyrazolo[5,4-b]pyridin-6-yl)-2-pyridin-3-yl-1,3-thiazole?
The InChIKey is FVFQEYVYJHVXTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N5S/c1-20-14-10(8-18-20)4-5-12(19-14)13-9-17-15(21-13)11-3-2-6-16-7-11/h2-9H,1H3.
What are the key properties of 5-(1-methylpyrazolo[5,4-b]pyridin-6-yl)-2-pyridin-3-yl-1,3-thiazole?
5-(1-methylpyrazolo[5,4-b]pyridin-6-yl)-2-pyridin-3-yl-1,3-thiazole has a molecular weight of 293.36 g/mol, XLogP of 3.15, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-methylpyrazolo[5,4-b]pyridin-6-yl)-2-pyridin-3-yl-1,3-thiazole is sourced from PubChem (CID 123365126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).