3-chloro-5-(difluoromethyl)-2,4-dimethoxypyridine

C8H8ClF2NO2 — CID 130100817

IUPAC3-chloro-5-(difluoromethyl)-2,4-dimethoxypyridine
SMILESCOc1ncc(C(F)F)c(OC)c1Cl
InChIInChI=1S/C8H8ClF2NO2/c1-13-6-4(7(10)11)3-12-8(14-2)5(6)9/h3,7H,1-2H3
InChIKeyCEFUKODEHZOTCE-UHFFFAOYSA-N
MW223.61 g/mol
LogP2.69
Rot. Bonds3

About 3-chloro-5-(difluoromethyl)-2,4-dimethoxypyridine

3-chloro-5-(difluoromethyl)-2,4-dimethoxypyridine (PubChem CID 130100817) has the molecular formula C8H8ClF2NO2 and a molecular weight of 223.61 g/mol. Its IUPAC name is 3-chloro-5-(difluoromethyl)-2,4-dimethoxypyridine.

Molecular Properties

Compound Name3-chloro-5-(difluoromethyl)-2,4-dimethoxypyridine
PubChem CID130100817
Molecular FormulaC8H8ClF2NO2
Molecular Weight223.61 g/mol
Exact Mass223.02
IUPAC Name3-chloro-5-(difluoromethyl)-2,4-dimethoxypyridine
SMILESCOc1ncc(C(F)F)c(OC)c1Cl
InChIInChI=1S/C8H8ClF2NO2/c1-13-6-4(7(10)11)3-12-8(14-2)5(6)9/h3,7H,1-2H3
InChIKeyCEFUKODEHZOTCE-UHFFFAOYSA-N
XLogP2.69
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.61
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3,4-dichloro-5-(difluoromethyl)-2-methoxypyridine
CID 130099248
3-chloro-5-(difluoromethyl)-2-iodo-4-methoxypyridine
CID 130072984
[3-chloro-5-(difluoromethyl)-4-methoxy-2-pyridinyl]methanol
CID 130073890
3-chloro-5-(difluoromethyl)-4-methoxypyridine-2-carbaldehyde
CID 130073927
3-chloro-5-(difluoromethyl)-4-methoxypyridine-2-sulfonyl chloride
CID 130074018
3,5-dichloro-4-(difluoromethyl)-2-methoxypyridine
CID 130099252
3-chloro-4-(difluoromethyl)-2-methoxy-5-methylpyridine
CID 130073666
3-chloro-4-(difluoromethyl)-5-fluoro-2-methoxypyridine
CID 130071589
2-chloro-5-(difluoromethyl)-4-methoxypyridine-3-sulfonyl chloride
CID 130073994
2-(chloromethyl)-5-(difluoromethyl)-3-fluoro-4-methoxypyridine
CID 130080662
5-(difluoromethyl)-6-methoxypyridin-3-ol
CID 130096969
3-bromo-5-(difluoromethyl)-2-fluoro-4-methoxypyridine
CID 130109360

Frequently Asked Questions

What is the IUPAC name of 3-chloro-5-(difluoromethyl)-2,4-dimethoxypyridine?
The IUPAC name of 3-chloro-5-(difluoromethyl)-2,4-dimethoxypyridine (CID 130100817) is 3-chloro-5-(difluoromethyl)-2,4-dimethoxypyridine.
What is the SMILES notation for 3-chloro-5-(difluoromethyl)-2,4-dimethoxypyridine?
The canonical SMILES for 3-chloro-5-(difluoromethyl)-2,4-dimethoxypyridine is COc1ncc(C(F)F)c(OC)c1Cl.
What is the InChIKey of 3-chloro-5-(difluoromethyl)-2,4-dimethoxypyridine?
The InChIKey is CEFUKODEHZOTCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8ClF2NO2/c1-13-6-4(7(10)11)3-12-8(14-2)5(6)9/h3,7H,1-2H3.
What are the key properties of 3-chloro-5-(difluoromethyl)-2,4-dimethoxypyridine?
3-chloro-5-(difluoromethyl)-2,4-dimethoxypyridine has a molecular weight of 223.61 g/mol, XLogP of 2.69, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-5-(difluoromethyl)-2,4-dimethoxypyridine is sourced from PubChem (CID 130100817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).