2-(4-chlorophenyl)-4-(furan-2-yl)-6-(3-methylthiophen-2-yl)pyridine

C20H14ClNOS — CID 46201019

IUPAC2-(4-chlorophenyl)-4-(furan-2-yl)-6-(3-methylthiophen-2-yl)pyridine
SMILESCc1ccsc1-c1cc(-c2ccco2)cc(-c2ccc(Cl)cc2)n1
InChIInChI=1S/C20H14ClNOS/c1-13-8-10-24-20(13)18-12-15(19-3-2-9-23-19)11-17(22-18)14-4-6-16(21)7-5-14/h2-12H,1H3
InChIKeyWXRLVLFJEYVHKL-UHFFFAOYSA-N
MW351.86 g/mol
LogP6.70
Rot. Bonds3

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

2-(4-chlorophenyl)-4-(furan-2-yl)-6-(3-methylthiophen-2-yl)pyridine (PubChem CID 46201019) has the molecular formula C20H14ClNOS and a molecular weight of 351.86 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-4-(furan-2-yl)-6-(3-methylthiophen-2-yl)pyridine.

Molecular Properties

Compound Name2-(4-chlorophenyl)-4-(furan-2-yl)-6-(3-methylthiophen-2-yl)pyridine
PubChem CID46201019
Molecular FormulaC20H14ClNOS
Molecular Weight351.86 g/mol
Exact Mass351.05
IUPAC Name2-(4-chlorophenyl)-4-(furan-2-yl)-6-(3-methylthiophen-2-yl)pyridine
SMILESCc1ccsc1-c1cc(-c2ccco2)cc(-c2ccc(Cl)cc2)n1
InChIInChI=1S/C20H14ClNOS/c1-13-8-10-24-20(13)18-12-15(19-3-2-9-23-19)11-17(22-18)14-4-6-16(21)7-5-14/h2-12H,1H3
InChIKeyWXRLVLFJEYVHKL-UHFFFAOYSA-N
XLogP6.70
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500351.86
LogP ≤ 56.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-4-(furan-2-yl)-6-(3-methylthiophen-2-yl)pyridine?
The IUPAC name of 2-(4-chlorophenyl)-4-(furan-2-yl)-6-(3-methylthiophen-2-yl)pyridine (CID 46201019) is 2-(4-chlorophenyl)-4-(furan-2-yl)-6-(3-methylthiophen-2-yl)pyridine.
What is the SMILES notation for 2-(4-chlorophenyl)-4-(furan-2-yl)-6-(3-methylthiophen-2-yl)pyridine?
The canonical SMILES for 2-(4-chlorophenyl)-4-(furan-2-yl)-6-(3-methylthiophen-2-yl)pyridine is Cc1ccsc1-c1cc(-c2ccco2)cc(-c2ccc(Cl)cc2)n1.
What is the InChIKey of 2-(4-chlorophenyl)-4-(furan-2-yl)-6-(3-methylthiophen-2-yl)pyridine?
The InChIKey is WXRLVLFJEYVHKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14ClNOS/c1-13-8-10-24-20(13)18-12-15(19-3-2-9-23-19)11-17(22-18)14-4-6-16(21)7-5-14/h2-12H,1H3.
What are the key properties of 2-(4-chlorophenyl)-4-(furan-2-yl)-6-(3-methylthiophen-2-yl)pyridine?
2-(4-chlorophenyl)-4-(furan-2-yl)-6-(3-methylthiophen-2-yl)pyridine has a molecular weight of 351.86 g/mol, XLogP of 6.70, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-4-(furan-2-yl)-6-(3-methylthiophen-2-yl)pyridine is sourced from PubChem (CID 46201019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).