4-chloro-2-(4-chloro-2-methylthiophen-3-yl)pyridine

C10H7Cl2NS — CID 67388370

IUPAC4-chloro-2-(4-chloro-2-methylthiophen-3-yl)pyridine
SMILESCc1scc(Cl)c1-c1cc(Cl)ccn1
InChIInChI=1S/C10H7Cl2NS/c1-6-10(8(12)5-14-6)9-4-7(11)2-3-13-9/h2-5H,1H3
InChIKeyIMVOFONMGBFLNV-UHFFFAOYSA-N
MW244.15 g/mol
LogP4.43
Rot. Bonds1

About 4-chloro-2-(4-chloro-2-methylthiophen-3-yl)pyridine

4-chloro-2-(4-chloro-2-methylthiophen-3-yl)pyridine (PubChem CID 67388370) has the molecular formula C10H7Cl2NS and a molecular weight of 244.15 g/mol. Its IUPAC name is 4-chloro-2-(4-chloro-2-methylthiophen-3-yl)pyridine.

Molecular Properties

Compound Name4-chloro-2-(4-chloro-2-methylthiophen-3-yl)pyridine
PubChem CID67388370
Molecular FormulaC10H7Cl2NS
Molecular Weight244.15 g/mol
Exact Mass242.97
IUPAC Name4-chloro-2-(4-chloro-2-methylthiophen-3-yl)pyridine
SMILESCc1scc(Cl)c1-c1cc(Cl)ccn1
InChIInChI=1S/C10H7Cl2NS/c1-6-10(8(12)5-14-6)9-4-7(11)2-3-13-9/h2-5H,1H3
InChIKeyIMVOFONMGBFLNV-UHFFFAOYSA-N
XLogP4.43
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.15
LogP ≤ 54.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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4-chloro-2,6-bis(4-chloro-2-pyridinyl)pyridine
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4-chloro-2-(4-chloro-2-methylsulfanylphenyl)pyridine
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3-(2-chlorophenyl)-2,4-dimethylthiophene
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Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-(4-chloro-2-methylthiophen-3-yl)pyridine?
The IUPAC name of 4-chloro-2-(4-chloro-2-methylthiophen-3-yl)pyridine (CID 67388370) is 4-chloro-2-(4-chloro-2-methylthiophen-3-yl)pyridine.
What is the SMILES notation for 4-chloro-2-(4-chloro-2-methylthiophen-3-yl)pyridine?
The canonical SMILES for 4-chloro-2-(4-chloro-2-methylthiophen-3-yl)pyridine is Cc1scc(Cl)c1-c1cc(Cl)ccn1.
What is the InChIKey of 4-chloro-2-(4-chloro-2-methylthiophen-3-yl)pyridine?
The InChIKey is IMVOFONMGBFLNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7Cl2NS/c1-6-10(8(12)5-14-6)9-4-7(11)2-3-13-9/h2-5H,1H3.
What are the key properties of 4-chloro-2-(4-chloro-2-methylthiophen-3-yl)pyridine?
4-chloro-2-(4-chloro-2-methylthiophen-3-yl)pyridine has a molecular weight of 244.15 g/mol, XLogP of 4.43, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-(4-chloro-2-methylthiophen-3-yl)pyridine is sourced from PubChem (CID 67388370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).