3,4-dichloro-5-(difluoromethyl)-2-methoxypyridine

C7H5Cl2F2NO — CID 130099248

IUPAC3,4-dichloro-5-(difluoromethyl)-2-methoxypyridine
SMILESCOc1ncc(C(F)F)c(Cl)c1Cl
InChIInChI=1S/C7H5Cl2F2NO/c1-13-7-5(9)4(8)3(2-12-7)6(10)11/h2,6H,1H3
InChIKeyKCEWGHLHGRKIJR-UHFFFAOYSA-N
MW228.03 g/mol
LogP3.33
Rot. Bonds2

About 3,4-dichloro-5-(difluoromethyl)-2-methoxypyridine

3,4-dichloro-5-(difluoromethyl)-2-methoxypyridine (PubChem CID 130099248) has the molecular formula C7H5Cl2F2NO and a molecular weight of 228.03 g/mol. Its IUPAC name is 3,4-dichloro-5-(difluoromethyl)-2-methoxypyridine.

Molecular Properties

Compound Name3,4-dichloro-5-(difluoromethyl)-2-methoxypyridine
PubChem CID130099248
Molecular FormulaC7H5Cl2F2NO
Molecular Weight228.03 g/mol
Exact Mass226.97
IUPAC Name3,4-dichloro-5-(difluoromethyl)-2-methoxypyridine
SMILESCOc1ncc(C(F)F)c(Cl)c1Cl
InChIInChI=1S/C7H5Cl2F2NO/c1-13-7-5(9)4(8)3(2-12-7)6(10)11/h2,6H,1H3
InChIKeyKCEWGHLHGRKIJR-UHFFFAOYSA-N
XLogP3.33
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.03
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-chloro-5-(difluoromethyl)-2,4-dimethoxypyridine
CID 130100817
3-chloro-4-(difluoromethyl)-5-fluoro-2-methoxypyridine
CID 130071589
3,5-dichloro-4-(difluoromethyl)-2-methoxypyridine
CID 130099252
3-chloro-4-(difluoromethyl)-2-methoxy-5-methylpyridine
CID 130073666
ethyl 4-chloro-5-(difluoromethyl)-2-methoxypyridine-3-carboxylate
CID 134674054
3,4-dichloro-5-(difluoromethyl)-2-fluoropyridine
CID 130099211
5-(difluoromethyl)-6-methoxypyridin-3-ol
CID 130096969
3-chloro-4-(difluoromethyl)-2-methoxy-5-nitropyridine
CID 134686343
3-chloro-5-(difluoromethyl)-2-iodo-4-methoxypyridine
CID 130072984
5-(difluoromethyl)-3-iodo-2-methoxypyridin-4-amine
CID 118806527
[4-chloro-5-(difluoromethyl)-6-methoxy-3-pyridinyl]methanamine
CID 130073716
5-(difluoromethyl)-2-methoxy-4-methyl-3-(trifluoromethyl)pyridine
CID 133100579

Frequently Asked Questions

What is the IUPAC name of 3,4-dichloro-5-(difluoromethyl)-2-methoxypyridine?
The IUPAC name of 3,4-dichloro-5-(difluoromethyl)-2-methoxypyridine (CID 130099248) is 3,4-dichloro-5-(difluoromethyl)-2-methoxypyridine.
What is the SMILES notation for 3,4-dichloro-5-(difluoromethyl)-2-methoxypyridine?
The canonical SMILES for 3,4-dichloro-5-(difluoromethyl)-2-methoxypyridine is COc1ncc(C(F)F)c(Cl)c1Cl.
What is the InChIKey of 3,4-dichloro-5-(difluoromethyl)-2-methoxypyridine?
The InChIKey is KCEWGHLHGRKIJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5Cl2F2NO/c1-13-7-5(9)4(8)3(2-12-7)6(10)11/h2,6H,1H3.
What are the key properties of 3,4-dichloro-5-(difluoromethyl)-2-methoxypyridine?
3,4-dichloro-5-(difluoromethyl)-2-methoxypyridine has a molecular weight of 228.03 g/mol, XLogP of 3.33, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dichloro-5-(difluoromethyl)-2-methoxypyridine is sourced from PubChem (CID 130099248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).