3-chloro-2-methylpyridine;dichloromethane

C7H8Cl3N — CID 174920232

IUPAC3-chloro-2-methylpyridine;dichloromethane
SMILESCc1ncccc1Cl.ClCCl
InChIInChI=1S/C6H6ClN.CH2Cl2/c1-5-6(7)3-2-4-8-5;2-1-3/h2-4H,1H3;1H2
InChIKeyXZJHKQWSONLYHL-UHFFFAOYSA-N
MW212.51 g/mol
LogP3.46
Rot. Bonds

About 3-chloro-2-methylpyridine;dichloromethane

3-chloro-2-methylpyridine;dichloromethane (PubChem CID 174920232) has the molecular formula C7H8Cl3N and a molecular weight of 212.51 g/mol. Its IUPAC name is 3-chloro-2-methylpyridine;dichloromethane.

Molecular Properties

Compound Name3-chloro-2-methylpyridine;dichloromethane
PubChem CID174920232
Molecular FormulaC7H8Cl3N
Molecular Weight212.51 g/mol
Exact Mass210.97
IUPAC Name3-chloro-2-methylpyridine;dichloromethane
SMILESCc1ncccc1Cl.ClCCl
InChIInChI=1S/C6H6ClN.CH2Cl2/c1-5-6(7)3-2-4-8-5;2-1-3/h2-4H,1H3;1H2
InChIKeyXZJHKQWSONLYHL-UHFFFAOYSA-N
XLogP3.46
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.51
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

3-chloro-2-methylpyridine;formaldehyde
CID 175449044
3-(3-chloropropyl)-2-methylpyridine
CID 86128501
3-chloro-2-(3-chloro-2-pyridinyl)pyridine;palladium(2+)
CID 18935247
azane;2,3-dichloropyridine
CID 174689212
bis(2,3-dimethylpyridine);ethane
CID 159594018
4-chloro-3-fluoro-2-methylpyridine
CID 18727750
3-chloro-2-[[(2-methyl-3-pyridinyl)amino]methyl]phenol
CID 114318234
2-bromo-3-methylpyridine;3-chloro-2-methylpyridine;2-methyl-3-(trifluoromethyl)pyridine
CID 157346640
1,3-dichloro-2-methylbenzene;bis(2,3-dimethylpyridine);1-fluoro-2-methylbenzene
CID 158361621
2-(2,6-dichlorophenyl)-3-methylpyridine
CID 118841939
2-chloro-6-[[(2-methyl-3-pyridinyl)amino]methyl]phenol
CID 112554995
(3-chloro-2-pyridinyl)-methylazanium
CID 144971363

Frequently Asked Questions

What is the IUPAC name of 3-chloro-2-methylpyridine;dichloromethane?
The IUPAC name of 3-chloro-2-methylpyridine;dichloromethane (CID 174920232) is 3-chloro-2-methylpyridine;dichloromethane.
What is the SMILES notation for 3-chloro-2-methylpyridine;dichloromethane?
The canonical SMILES for 3-chloro-2-methylpyridine;dichloromethane is Cc1ncccc1Cl.ClCCl.
What is the InChIKey of 3-chloro-2-methylpyridine;dichloromethane?
The InChIKey is XZJHKQWSONLYHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6ClN.CH2Cl2/c1-5-6(7)3-2-4-8-5;2-1-3/h2-4H,1H3;1H2.
What are the key properties of 3-chloro-2-methylpyridine;dichloromethane?
3-chloro-2-methylpyridine;dichloromethane has a molecular weight of 212.51 g/mol, XLogP of 3.46, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-2-methylpyridine;dichloromethane is sourced from PubChem (CID 174920232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).