4-(furan-2-yl)-2,6-bis(3-methylthiophen-2-yl)pyridine

C19H15NOS2 — CID 46224888

IUPAC4-(furan-2-yl)-2,6-bis(3-methylthiophen-2-yl)pyridine
SMILESCc1ccsc1-c1cc(-c2ccco2)cc(-c2sccc2C)n1
InChIInChI=1S/C19H15NOS2/c1-12-5-8-22-18(12)15-10-14(17-4-3-7-21-17)11-16(20-15)19-13(2)6-9-23-19/h3-11H,1-2H3
InChIKeyHSMOWZPSKOZFES-UHFFFAOYSA-N
MW337.47 g/mol
LogP6.42
Rot. Bonds3

About 4-(furan-2-yl)-2,6-bis(3-methylthiophen-2-yl)pyridine

4-(furan-2-yl)-2,6-bis(3-methylthiophen-2-yl)pyridine (PubChem CID 46224888) has the molecular formula C19H15NOS2 and a molecular weight of 337.47 g/mol. Its IUPAC name is 4-(furan-2-yl)-2,6-bis(3-methylthiophen-2-yl)pyridine.

Molecular Properties

Compound Name4-(furan-2-yl)-2,6-bis(3-methylthiophen-2-yl)pyridine
PubChem CID46224888
Molecular FormulaC19H15NOS2
Molecular Weight337.47 g/mol
Exact Mass337.06
IUPAC Name4-(furan-2-yl)-2,6-bis(3-methylthiophen-2-yl)pyridine
SMILESCc1ccsc1-c1cc(-c2ccco2)cc(-c2sccc2C)n1
InChIInChI=1S/C19H15NOS2/c1-12-5-8-22-18(12)15-10-14(17-4-3-7-21-17)11-16(20-15)19-13(2)6-9-23-19/h3-11H,1-2H3
InChIKeyHSMOWZPSKOZFES-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-(furan-2-yl)-2,6-bis(3-methylthiophen-2-yl)pyridine?
The IUPAC name of 4-(furan-2-yl)-2,6-bis(3-methylthiophen-2-yl)pyridine (CID 46224888) is 4-(furan-2-yl)-2,6-bis(3-methylthiophen-2-yl)pyridine.
What is the SMILES notation for 4-(furan-2-yl)-2,6-bis(3-methylthiophen-2-yl)pyridine?
The canonical SMILES for 4-(furan-2-yl)-2,6-bis(3-methylthiophen-2-yl)pyridine is Cc1ccsc1-c1cc(-c2ccco2)cc(-c2sccc2C)n1.
What is the InChIKey of 4-(furan-2-yl)-2,6-bis(3-methylthiophen-2-yl)pyridine?
The InChIKey is HSMOWZPSKOZFES-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15NOS2/c1-12-5-8-22-18(12)15-10-14(17-4-3-7-21-17)11-16(20-15)19-13(2)6-9-23-19/h3-11H,1-2H3.
What are the key properties of 4-(furan-2-yl)-2,6-bis(3-methylthiophen-2-yl)pyridine?
4-(furan-2-yl)-2,6-bis(3-methylthiophen-2-yl)pyridine 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-(furan-2-yl)-2,6-bis(3-methylthiophen-2-yl)pyridine is sourced from PubChem (CID 46224888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).