4-amino-2-indazol-1-ylthieno[3,2-c]pyridine-7-carbonitrile

C15H9N5S — CID 141157007

IUPAC4-amino-2-indazol-1-ylthieno[3,2-c]pyridine-7-carbonitrile
SMILESN#Cc1cnc(N)c2cc(-n3ncc4ccccc43)sc12
InChIInChI=1S/C15H9N5S/c16-6-10-7-18-15(17)11-5-13(21-14(10)11)20-12-4-2-1-3-9(12)8-19-20/h1-5,7-8H,(H2,17,18)
InChIKeyYWMKXCIEIJFQBB-UHFFFAOYSA-N
MW291.34 g/mol
LogP3.09
Rot. Bonds1

About 4-amino-2-indazol-1-ylthieno[3,2-c]pyridine-7-carbonitrile

4-amino-2-indazol-1-ylthieno[3,2-c]pyridine-7-carbonitrile (PubChem CID 141157007) has the molecular formula C15H9N5S and a molecular weight of 291.34 g/mol. Its IUPAC name is 4-amino-2-indazol-1-ylthieno[3,2-c]pyridine-7-carbonitrile.

Molecular Properties

Compound Name4-amino-2-indazol-1-ylthieno[3,2-c]pyridine-7-carbonitrile
PubChem CID141157007
Molecular FormulaC15H9N5S
Molecular Weight291.34 g/mol
Exact Mass291.06
IUPAC Name4-amino-2-indazol-1-ylthieno[3,2-c]pyridine-7-carbonitrile
SMILESN#Cc1cnc(N)c2cc(-n3ncc4ccccc43)sc12
InChIInChI=1S/C15H9N5S/c16-6-10-7-18-15(17)11-5-13(21-14(10)11)20-12-4-2-1-3-9(12)8-19-20/h1-5,7-8H,(H2,17,18)
InChIKeyYWMKXCIEIJFQBB-UHFFFAOYSA-N
XLogP3.09
TPSA80.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.34
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-amino-2-indazol-1-ylthieno[3,2-c]pyridine-7-carbonitrile?
The IUPAC name of 4-amino-2-indazol-1-ylthieno[3,2-c]pyridine-7-carbonitrile (CID 141157007) is 4-amino-2-indazol-1-ylthieno[3,2-c]pyridine-7-carbonitrile.
What is the SMILES notation for 4-amino-2-indazol-1-ylthieno[3,2-c]pyridine-7-carbonitrile?
The canonical SMILES for 4-amino-2-indazol-1-ylthieno[3,2-c]pyridine-7-carbonitrile is N#Cc1cnc(N)c2cc(-n3ncc4ccccc43)sc12.
What is the InChIKey of 4-amino-2-indazol-1-ylthieno[3,2-c]pyridine-7-carbonitrile?
The InChIKey is YWMKXCIEIJFQBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9N5S/c16-6-10-7-18-15(17)11-5-13(21-14(10)11)20-12-4-2-1-3-9(12)8-19-20/h1-5,7-8H,(H2,17,18).
What are the key properties of 4-amino-2-indazol-1-ylthieno[3,2-c]pyridine-7-carbonitrile?
4-amino-2-indazol-1-ylthieno[3,2-c]pyridine-7-carbonitrile has a molecular weight of 291.34 g/mol, XLogP of 3.09, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2-indazol-1-ylthieno[3,2-c]pyridine-7-carbonitrile is sourced from PubChem (CID 141157007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).