4-(5-methylfuran-2-yl)-2-(3-methylthiophen-2-yl)-6-thiophen-3-ylpyridine

C19H15NOS2 — CID 46224887

IUPAC4-(5-methylfuran-2-yl)-2-(3-methylthiophen-2-yl)-6-thiophen-3-ylpyridine
SMILESCc1ccc(-c2cc(-c3ccsc3)nc(-c3sccc3C)c2)o1
InChIInChI=1S/C19H15NOS2/c1-12-5-8-23-19(12)17-10-15(18-4-3-13(2)21-18)9-16(20-17)14-6-7-22-11-14/h3-11H,1-2H3
InChIKeyRTPPFPANRUJCKD-UHFFFAOYSA-N
MW337.47 g/mol
LogP6.42
Rot. Bonds3

About 4-(5-methylfuran-2-yl)-2-(3-methylthiophen-2-yl)-6-thiophen-3-ylpyridine

4-(5-methylfuran-2-yl)-2-(3-methylthiophen-2-yl)-6-thiophen-3-ylpyridine (PubChem CID 46224887) has the molecular formula C19H15NOS2 and a molecular weight of 337.47 g/mol. Its IUPAC name is 4-(5-methylfuran-2-yl)-2-(3-methylthiophen-2-yl)-6-thiophen-3-ylpyridine.

Molecular Properties

Compound Name4-(5-methylfuran-2-yl)-2-(3-methylthiophen-2-yl)-6-thiophen-3-ylpyridine
PubChem CID46224887
Molecular FormulaC19H15NOS2
Molecular Weight337.47 g/mol
Exact Mass337.06
IUPAC Name4-(5-methylfuran-2-yl)-2-(3-methylthiophen-2-yl)-6-thiophen-3-ylpyridine
SMILESCc1ccc(-c2cc(-c3ccsc3)nc(-c3sccc3C)c2)o1
InChIInChI=1S/C19H15NOS2/c1-12-5-8-23-19(12)17-10-15(18-4-3-13(2)21-18)9-16(20-17)14-6-7-22-11-14/h3-11H,1-2H3
InChIKeyRTPPFPANRUJCKD-UHFFFAOYSA-N
XLogP6.42
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500337.47
LogP ≤ 56.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(5-methylfuran-2-yl)-2-(3-methylthiophen-2-yl)-6-thiophen-3-ylpyridine?
The IUPAC name of 4-(5-methylfuran-2-yl)-2-(3-methylthiophen-2-yl)-6-thiophen-3-ylpyridine (CID 46224887) is 4-(5-methylfuran-2-yl)-2-(3-methylthiophen-2-yl)-6-thiophen-3-ylpyridine.
What is the SMILES notation for 4-(5-methylfuran-2-yl)-2-(3-methylthiophen-2-yl)-6-thiophen-3-ylpyridine?
The canonical SMILES for 4-(5-methylfuran-2-yl)-2-(3-methylthiophen-2-yl)-6-thiophen-3-ylpyridine is Cc1ccc(-c2cc(-c3ccsc3)nc(-c3sccc3C)c2)o1.
What is the InChIKey of 4-(5-methylfuran-2-yl)-2-(3-methylthiophen-2-yl)-6-thiophen-3-ylpyridine?
The InChIKey is RTPPFPANRUJCKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15NOS2/c1-12-5-8-23-19(12)17-10-15(18-4-3-13(2)21-18)9-16(20-17)14-6-7-22-11-14/h3-11H,1-2H3.
What are the key properties of 4-(5-methylfuran-2-yl)-2-(3-methylthiophen-2-yl)-6-thiophen-3-ylpyridine?
4-(5-methylfuran-2-yl)-2-(3-methylthiophen-2-yl)-6-thiophen-3-ylpyridine has a molecular weight of 337.47 g/mol, XLogP of 6.42, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-methylfuran-2-yl)-2-(3-methylthiophen-2-yl)-6-thiophen-3-ylpyridine is sourced from PubChem (CID 46224887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).