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

C9H5Cl2NS — CID 107360947

IUPAC4-chloro-2-(3-chlorothiophen-2-yl)pyridine
SMILESClc1ccnc(-c2sccc2Cl)c1
InChIInChI=1S/C9H5Cl2NS/c10-6-1-3-12-8(5-6)9-7(11)2-4-13-9/h1-5H
InChIKeyUIXKBOGDHGSNGT-UHFFFAOYSA-N
MW230.12 g/mol
LogP4.12
Rot. Bonds1

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

4-chloro-2-(3-chlorothiophen-2-yl)pyridine (PubChem CID 107360947) has the molecular formula C9H5Cl2NS and a molecular weight of 230.12 g/mol. Its IUPAC name is 4-chloro-2-(3-chlorothiophen-2-yl)pyridine.

Molecular Properties

Compound Name4-chloro-2-(3-chlorothiophen-2-yl)pyridine
PubChem CID107360947
Molecular FormulaC9H5Cl2NS
Molecular Weight230.12 g/mol
Exact Mass228.95
IUPAC Name4-chloro-2-(3-chlorothiophen-2-yl)pyridine
SMILESClc1ccnc(-c2sccc2Cl)c1
InChIInChI=1S/C9H5Cl2NS/c10-6-1-3-12-8(5-6)9-7(11)2-4-13-9/h1-5H
InChIKeyUIXKBOGDHGSNGT-UHFFFAOYSA-N
XLogP4.12
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.12
LogP ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-(3-chlorothiophen-2-yl)pyridine?
The IUPAC name of 4-chloro-2-(3-chlorothiophen-2-yl)pyridine (CID 107360947) is 4-chloro-2-(3-chlorothiophen-2-yl)pyridine.
What is the SMILES notation for 4-chloro-2-(3-chlorothiophen-2-yl)pyridine?
The canonical SMILES for 4-chloro-2-(3-chlorothiophen-2-yl)pyridine is Clc1ccnc(-c2sccc2Cl)c1.
What is the InChIKey of 4-chloro-2-(3-chlorothiophen-2-yl)pyridine?
The InChIKey is UIXKBOGDHGSNGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H5Cl2NS/c10-6-1-3-12-8(5-6)9-7(11)2-4-13-9/h1-5H.
What are the key properties of 4-chloro-2-(3-chlorothiophen-2-yl)pyridine?
4-chloro-2-(3-chlorothiophen-2-yl)pyridine has a molecular weight of 230.12 g/mol, XLogP of 4.12, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-(3-chlorothiophen-2-yl)pyridine is sourced from PubChem (CID 107360947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).