2-chloro-6-(1,3-dioxolan-2-yl)pyridine

C8H8ClNO2 — CID 150069139

IUPAC2-chloro-6-(1,3-dioxolan-2-yl)pyridine
SMILESClc1cccc(C2OCCO2)n1
InChIInChI=1S/C8H8ClNO2/c9-7-3-1-2-6(10-7)8-11-4-5-12-8/h1-3,8H,4-5H2
InChIKeyDOXCKCZMJWLQAP-UHFFFAOYSA-N
MW185.61 g/mol
LogP1.78
Rot. Bonds1

About 2-chloro-6-(1,3-dioxolan-2-yl)pyridine

2-chloro-6-(1,3-dioxolan-2-yl)pyridine (PubChem CID 150069139) has the molecular formula C8H8ClNO2 and a molecular weight of 185.61 g/mol. Its IUPAC name is 2-chloro-6-(1,3-dioxolan-2-yl)pyridine.

Molecular Properties

Compound Name2-chloro-6-(1,3-dioxolan-2-yl)pyridine
PubChem CID150069139
Molecular FormulaC8H8ClNO2
Molecular Weight185.61 g/mol
Exact Mass185.02
IUPAC Name2-chloro-6-(1,3-dioxolan-2-yl)pyridine
SMILESClc1cccc(C2OCCO2)n1
InChIInChI=1S/C8H8ClNO2/c9-7-3-1-2-6(10-7)8-11-4-5-12-8/h1-3,8H,4-5H2
InChIKeyDOXCKCZMJWLQAP-UHFFFAOYSA-N
XLogP1.78
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.61
LogP ≤ 51.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2-Pyridinyl-1,3-dioxolane
CID 79773
2-Bromo-6-(1,3-dioxolan-2-yl)pyridine
CID 118613
2-(1,3,-Dioxolan-2-yl)-6-methylpyridine
CID 2734304
2-(1,3-Dioxolan-2-yl)-6-fluoropyridine
CID 10559050
2-Chloro-6-(oxiran-2-yl)pyridine
CID 15067150
CID 12300608
CID 12300608
2-(2-Methyl-1,3-dioxolan-2-yl)-6-(tributylstannyl)pyridine
CID 11518123
[6-(1,3-Dioxolan-2-yl)-2-pyridinyl]-trimethylsilane
CID 18551757
2,6-Bis(dimethoxymethyl)pyridine
CID 101076713
Pyridine, 2-(difluoromethyl)-6-(1,3-dioxolan-2-yl)-
CID 19361744
2-[1,3]Dioxolan-2-yl-6-(1-fluoroethyl)pyridine
CID 19361750
2-(1,3-Dioxolan-2-yl)-5-fluoropyridine
CID 23114794

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-(1,3-dioxolan-2-yl)pyridine?
The IUPAC name of 2-chloro-6-(1,3-dioxolan-2-yl)pyridine (CID 150069139) is 2-chloro-6-(1,3-dioxolan-2-yl)pyridine.
What is the SMILES notation for 2-chloro-6-(1,3-dioxolan-2-yl)pyridine?
The canonical SMILES for 2-chloro-6-(1,3-dioxolan-2-yl)pyridine is Clc1cccc(C2OCCO2)n1.
What is the InChIKey of 2-chloro-6-(1,3-dioxolan-2-yl)pyridine?
The InChIKey is DOXCKCZMJWLQAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8ClNO2/c9-7-3-1-2-6(10-7)8-11-4-5-12-8/h1-3,8H,4-5H2.
What are the key properties of 2-chloro-6-(1,3-dioxolan-2-yl)pyridine?
2-chloro-6-(1,3-dioxolan-2-yl)pyridine has a molecular weight of 185.61 g/mol, XLogP of 1.78, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-(1,3-dioxolan-2-yl)pyridine is sourced from PubChem (CID 150069139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).