5-chloro-2-(difluoromethyl)-3-methoxypyridine

C7H6ClF2NO — CID 130095452

IUPAC5-chloro-2-(difluoromethyl)-3-methoxypyridine
SMILESCOc1cc(Cl)cnc1C(F)F
InChIInChI=1S/C7H6ClF2NO/c1-12-5-2-4(8)3-11-6(5)7(9)10/h2-3,7H,1H3
InChIKeyLMPAFXUQUIIJCQ-UHFFFAOYSA-N
MW193.58 g/mol
LogP2.68
Rot. Bonds2

About 5-chloro-2-(difluoromethyl)-3-methoxypyridine

5-chloro-2-(difluoromethyl)-3-methoxypyridine (PubChem CID 130095452) has the molecular formula C7H6ClF2NO and a molecular weight of 193.58 g/mol. Its IUPAC name is 5-chloro-2-(difluoromethyl)-3-methoxypyridine.

Molecular Properties

Compound Name5-chloro-2-(difluoromethyl)-3-methoxypyridine
PubChem CID130095452
Molecular FormulaC7H6ClF2NO
Molecular Weight193.58 g/mol
Exact Mass193.01
IUPAC Name5-chloro-2-(difluoromethyl)-3-methoxypyridine
SMILESCOc1cc(Cl)cnc1C(F)F
InChIInChI=1S/C7H6ClF2NO/c1-12-5-2-4(8)3-11-6(5)7(9)10/h2-3,7H,1H3
InChIKeyLMPAFXUQUIIJCQ-UHFFFAOYSA-N
XLogP2.68
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.58
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

6-(difluoromethyl)-5-methoxypyridine-3-sulfonyl chloride
CID 118815341
5-chloro-2-(difluoromethyl)pyridin-3-amine
CID 130094579
3,5-dichloro-2-(difluoromethyl)pyridine
CID 60622989
5-chloro-2,3-dimethoxypyridine;hydrochloride
CID 91759024
methyl 3-chloro-2-(difluoromethyl)-5-methoxypyridine-4-carboxylate
CID 134674417
5-chloro-2-(difluoromethyl)-3-(fluoromethyl)pyridine
CID 130095561
2-(difluoromethyl)-3,4-difluoro-5-methoxypyridine
CID 130099673
4-chloro-2-(difluoromethyl)-5-methoxy-3-(trifluoromethoxy)pyridine
CID 118822429
2-(difluoromethyl)-4-fluoro-5-methoxy-3-methylpyridine
CID 130080514
4-bromo-2-(difluoromethyl)-5-methoxy-3-(trifluoromethyl)pyridine
CID 118806198
2-(5-chloro-3-methoxy-2-pyridinyl)acetic acid
CID 84670284
5-chloro-3-methoxypyridine-2-carbaldehyde;ethane
CID 144606570

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-(difluoromethyl)-3-methoxypyridine?
The IUPAC name of 5-chloro-2-(difluoromethyl)-3-methoxypyridine (CID 130095452) is 5-chloro-2-(difluoromethyl)-3-methoxypyridine.
What is the SMILES notation for 5-chloro-2-(difluoromethyl)-3-methoxypyridine?
The canonical SMILES for 5-chloro-2-(difluoromethyl)-3-methoxypyridine is COc1cc(Cl)cnc1C(F)F.
What is the InChIKey of 5-chloro-2-(difluoromethyl)-3-methoxypyridine?
The InChIKey is LMPAFXUQUIIJCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6ClF2NO/c1-12-5-2-4(8)3-11-6(5)7(9)10/h2-3,7H,1H3.
What are the key properties of 5-chloro-2-(difluoromethyl)-3-methoxypyridine?
5-chloro-2-(difluoromethyl)-3-methoxypyridine has a molecular weight of 193.58 g/mol, XLogP of 2.68, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-(difluoromethyl)-3-methoxypyridine is sourced from PubChem (CID 130095452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).