4-cyano-N-[3-(furan-3-yl)-1H-indazol-5-yl]thieno[2,3-c]pyridine-7-carboxamide

C20H11N5O2S — CID 155481781

IUPAC4-cyano-N-[3-(furan-3-yl)-1H-indazol-5-yl]thieno[2,3-c]pyridine-7-carboxamide
SMILESN#Cc1cnc(C(=O)Nc2ccc3[nH]nc(-c4ccoc4)c3c2)c2sccc12
InChIInChI=1S/C20H11N5O2S/c21-8-12-9-22-18(19-14(12)4-6-28-19)20(26)23-13-1-2-16-15(7-13)17(25-24-16)11-3-5-27-10-11/h1-7,9-10H,(H,23,26)(H,24,25)
InChIKeyHGKDTAUGQBPENH-UHFFFAOYSA-N
MW385.41 g/mol
LogP4.56
Rot. Bonds3

About 4-cyano-N-[3-(furan-3-yl)-1H-indazol-5-yl]thieno[2,3-c]pyridine-7-carboxamide

4-cyano-N-[3-(furan-3-yl)-1H-indazol-5-yl]thieno[2,3-c]pyridine-7-carboxamide (PubChem CID 155481781) has the molecular formula C20H11N5O2S and a molecular weight of 385.41 g/mol. Its IUPAC name is 4-cyano-N-[3-(furan-3-yl)-1H-indazol-5-yl]thieno[2,3-c]pyridine-7-carboxamide.

Molecular Properties

Compound Name4-cyano-N-[3-(furan-3-yl)-1H-indazol-5-yl]thieno[2,3-c]pyridine-7-carboxamide
PubChem CID155481781
Molecular FormulaC20H11N5O2S
Molecular Weight385.41 g/mol
Exact Mass385.06
IUPAC Name4-cyano-N-[3-(furan-3-yl)-1H-indazol-5-yl]thieno[2,3-c]pyridine-7-carboxamide
SMILESN#Cc1cnc(C(=O)Nc2ccc3[nH]nc(-c4ccoc4)c3c2)c2sccc12
InChIInChI=1S/C20H11N5O2S/c21-8-12-9-22-18(19-14(12)4-6-28-19)20(26)23-13-1-2-16-15(7-13)17(25-24-16)11-3-5-27-10-11/h1-7,9-10H,(H,23,26)(H,24,25)
InChIKeyHGKDTAUGQBPENH-UHFFFAOYSA-N
XLogP4.56
TPSA107.60 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.41
LogP ≤ 54.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-cyano-N-[3-(furan-3-yl)-1H-indazol-5-yl]thieno[2,3-c]pyridine-7-carboxamide?
The IUPAC name of 4-cyano-N-[3-(furan-3-yl)-1H-indazol-5-yl]thieno[2,3-c]pyridine-7-carboxamide (CID 155481781) is 4-cyano-N-[3-(furan-3-yl)-1H-indazol-5-yl]thieno[2,3-c]pyridine-7-carboxamide.
What is the SMILES notation for 4-cyano-N-[3-(furan-3-yl)-1H-indazol-5-yl]thieno[2,3-c]pyridine-7-carboxamide?
The canonical SMILES for 4-cyano-N-[3-(furan-3-yl)-1H-indazol-5-yl]thieno[2,3-c]pyridine-7-carboxamide is N#Cc1cnc(C(=O)Nc2ccc3[nH]nc(-c4ccoc4)c3c2)c2sccc12.
What is the InChIKey of 4-cyano-N-[3-(furan-3-yl)-1H-indazol-5-yl]thieno[2,3-c]pyridine-7-carboxamide?
The InChIKey is HGKDTAUGQBPENH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H11N5O2S/c21-8-12-9-22-18(19-14(12)4-6-28-19)20(26)23-13-1-2-16-15(7-13)17(25-24-16)11-3-5-27-10-11/h1-7,9-10H,(H,23,26)(H,24,25).
What are the key properties of 4-cyano-N-[3-(furan-3-yl)-1H-indazol-5-yl]thieno[2,3-c]pyridine-7-carboxamide?
4-cyano-N-[3-(furan-3-yl)-1H-indazol-5-yl]thieno[2,3-c]pyridine-7-carboxamide has a molecular weight of 385.41 g/mol, XLogP of 4.56, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyano-N-[3-(furan-3-yl)-1H-indazol-5-yl]thieno[2,3-c]pyridine-7-carboxamide is sourced from PubChem (CID 155481781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).