3-chloropyridine;3-methylpyridine

C11H11ClN2 — CID 174960532

IUPAC3-chloropyridine;3-methylpyridine
SMILESCc1cccnc1.Clc1cccnc1
InChIInChI=1S/C6H7N.C5H4ClN/c1-6-3-2-4-7-5-6;6-5-2-1-3-7-4-5/h2-5H,1H3;1-4H
InChIKeyAKYHMBQTOKPKNM-UHFFFAOYSA-N
MW206.68 g/mol
LogP3.13
Rot. Bonds

About 3-chloropyridine;3-methylpyridine

3-chloropyridine;3-methylpyridine (PubChem CID 174960532) has the molecular formula C11H11ClN2 and a molecular weight of 206.68 g/mol. Its IUPAC name is 3-chloropyridine;3-methylpyridine.

Molecular Properties

Compound Name3-chloropyridine;3-methylpyridine
PubChem CID174960532
Molecular FormulaC11H11ClN2
Molecular Weight206.68 g/mol
Exact Mass206.06
IUPAC Name3-chloropyridine;3-methylpyridine
SMILESCc1cccnc1.Clc1cccnc1
InChIInChI=1S/C6H7N.C5H4ClN/c1-6-3-2-4-7-5-6;6-5-2-1-3-7-4-5/h2-5H,1H3;1-4H
InChIKeyAKYHMBQTOKPKNM-UHFFFAOYSA-N
XLogP3.13
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.68
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

bis(3-methylpyridine);palladium(2+);dichloride
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bis(3-methylpyridine);platinum(2+);dichloride
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bis(3-methylpyridine);tetrachloroplatinum
CID 3415062
dichlorocobalt(1+);tetrakis(3-methylpyridine);chloride
CID 119057635
ethane;3-methylpyridine;hydroiodide
CID 143140941
2-chloro-5-methylpyridine;3-methylpyridine
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CID 142096313
ethane;methoxymethane;bis(3-methylpyridine)
CID 159558388
3-methylpyridine;4-methylpyridine
CID 21425791
ethane;methane;3-methylpyridine;toluene;1,4-xylene
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Frequently Asked Questions

What is the IUPAC name of 3-chloropyridine;3-methylpyridine?
The IUPAC name of 3-chloropyridine;3-methylpyridine (CID 174960532) is 3-chloropyridine;3-methylpyridine.
What is the SMILES notation for 3-chloropyridine;3-methylpyridine?
The canonical SMILES for 3-chloropyridine;3-methylpyridine is Cc1cccnc1.Clc1cccnc1.
What is the InChIKey of 3-chloropyridine;3-methylpyridine?
The InChIKey is AKYHMBQTOKPKNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N.C5H4ClN/c1-6-3-2-4-7-5-6;6-5-2-1-3-7-4-5/h2-5H,1H3;1-4H.
What are the key properties of 3-chloropyridine;3-methylpyridine?
3-chloropyridine;3-methylpyridine has a molecular weight of 206.68 g/mol, XLogP of 3.13, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloropyridine;3-methylpyridine is sourced from PubChem (CID 174960532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).