2-[(E)-1,2-dichloroethenyl]pyridine

C7H5Cl2N — CID 146396959

IUPAC2-[(E)-1,2-dichloroethenyl]pyridine
SMILESCl/C=C(/Cl)c1ccccn1
InChIInChI=1S/C7H5Cl2N/c8-5-6(9)7-3-1-2-4-10-7/h1-5H/b6-5+
InChIKeySGJDCOZNCVKZCO-AATRIKPKSA-N
MW174.03 g/mol
LogP2.86
Rot. Bonds1

About 2-[(E)-1,2-dichloroethenyl]pyridine

2-[(E)-1,2-dichloroethenyl]pyridine (PubChem CID 146396959) has the molecular formula C7H5Cl2N and a molecular weight of 174.03 g/mol. Its IUPAC name is 2-[(E)-1,2-dichloroethenyl]pyridine.

Molecular Properties

Compound Name2-[(E)-1,2-dichloroethenyl]pyridine
PubChem CID146396959
Molecular FormulaC7H5Cl2N
Molecular Weight174.03 g/mol
Exact Mass172.98
IUPAC Name2-[(E)-1,2-dichloroethenyl]pyridine
SMILESCl/C=C(/Cl)c1ccccn1
InChIInChI=1S/C7H5Cl2N/c8-5-6(9)7-3-1-2-4-10-7/h1-5H/b6-5+
InChIKeySGJDCOZNCVKZCO-AATRIKPKSA-N
XLogP2.86
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.03
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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ethyl pyridine-2-carboxylate
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Frequently Asked Questions

What is the IUPAC name of 2-[(E)-1,2-dichloroethenyl]pyridine?
The IUPAC name of 2-[(E)-1,2-dichloroethenyl]pyridine (CID 146396959) is 2-[(E)-1,2-dichloroethenyl]pyridine.
What is the SMILES notation for 2-[(E)-1,2-dichloroethenyl]pyridine?
The canonical SMILES for 2-[(E)-1,2-dichloroethenyl]pyridine is Cl/C=C(/Cl)c1ccccn1.
What is the InChIKey of 2-[(E)-1,2-dichloroethenyl]pyridine?
The InChIKey is SGJDCOZNCVKZCO-AATRIKPKSA-N. The full InChI is InChI=1S/C7H5Cl2N/c8-5-6(9)7-3-1-2-4-10-7/h1-5H/b6-5+.
What are the key properties of 2-[(E)-1,2-dichloroethenyl]pyridine?
2-[(E)-1,2-dichloroethenyl]pyridine has a molecular weight of 174.03 g/mol, XLogP of 2.86, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-1,2-dichloroethenyl]pyridine is sourced from PubChem (CID 146396959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).