7-(furan-2-yl)-3-(4-phenoxyphenyl)thieno[3,2-c]pyridin-4-amine

C23H16N2O2S — CID 18450866

IUPAC7-(furan-2-yl)-3-(4-phenoxyphenyl)thieno[3,2-c]pyridin-4-amine
SMILESNc1ncc(-c2ccco2)c2scc(-c3ccc(Oc4ccccc4)cc3)c12
InChIInChI=1S/C23H16N2O2S/c24-23-21-19(14-28-22(21)18(13-25-23)20-7-4-12-26-20)15-8-10-17(11-9-15)27-16-5-2-1-3-6-16/h1-14H,(H2,24,25)
InChIKeyHLQHOHXPLKICCU-UHFFFAOYSA-N
MW384.46 g/mol
LogP6.60
Rot. Bonds4

About 7-(furan-2-yl)-3-(4-phenoxyphenyl)thieno[3,2-c]pyridin-4-amine

7-(furan-2-yl)-3-(4-phenoxyphenyl)thieno[3,2-c]pyridin-4-amine (PubChem CID 18450866) has the molecular formula C23H16N2O2S and a molecular weight of 384.46 g/mol. Its IUPAC name is 7-(furan-2-yl)-3-(4-phenoxyphenyl)thieno[3,2-c]pyridin-4-amine.

Molecular Properties

Compound Name7-(furan-2-yl)-3-(4-phenoxyphenyl)thieno[3,2-c]pyridin-4-amine
PubChem CID18450866
Molecular FormulaC23H16N2O2S
Molecular Weight384.46 g/mol
Exact Mass384.09
IUPAC Name7-(furan-2-yl)-3-(4-phenoxyphenyl)thieno[3,2-c]pyridin-4-amine
SMILESNc1ncc(-c2ccco2)c2scc(-c3ccc(Oc4ccccc4)cc3)c12
InChIInChI=1S/C23H16N2O2S/c24-23-21-19(14-28-22(21)18(13-25-23)20-7-4-12-26-20)15-8-10-17(11-9-15)27-16-5-2-1-3-6-16/h1-14H,(H2,24,25)
InChIKeyHLQHOHXPLKICCU-UHFFFAOYSA-N
XLogP6.60
TPSA61.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.46
LogP ≤ 56.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-(furan-2-yl)-3-(4-phenoxyphenyl)thieno[3,2-c]pyridin-4-amine?
The IUPAC name of 7-(furan-2-yl)-3-(4-phenoxyphenyl)thieno[3,2-c]pyridin-4-amine (CID 18450866) is 7-(furan-2-yl)-3-(4-phenoxyphenyl)thieno[3,2-c]pyridin-4-amine.
What is the SMILES notation for 7-(furan-2-yl)-3-(4-phenoxyphenyl)thieno[3,2-c]pyridin-4-amine?
The canonical SMILES for 7-(furan-2-yl)-3-(4-phenoxyphenyl)thieno[3,2-c]pyridin-4-amine is Nc1ncc(-c2ccco2)c2scc(-c3ccc(Oc4ccccc4)cc3)c12.
What is the InChIKey of 7-(furan-2-yl)-3-(4-phenoxyphenyl)thieno[3,2-c]pyridin-4-amine?
The InChIKey is HLQHOHXPLKICCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16N2O2S/c24-23-21-19(14-28-22(21)18(13-25-23)20-7-4-12-26-20)15-8-10-17(11-9-15)27-16-5-2-1-3-6-16/h1-14H,(H2,24,25).
What are the key properties of 7-(furan-2-yl)-3-(4-phenoxyphenyl)thieno[3,2-c]pyridin-4-amine?
7-(furan-2-yl)-3-(4-phenoxyphenyl)thieno[3,2-c]pyridin-4-amine has a molecular weight of 384.46 g/mol, XLogP of 6.60, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(furan-2-yl)-3-(4-phenoxyphenyl)thieno[3,2-c]pyridin-4-amine is sourced from PubChem (CID 18450866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).