4-amino-5-(difluoromethyl)-2-methoxypyridine-3-sulfonyl chloride

C7H7ClF2N2O3S — CID 118817786

IUPAC4-amino-5-(difluoromethyl)-2-methoxypyridine-3-sulfonyl chloride
SMILESCOc1ncc(C(F)F)c(N)c1S(=O)(=O)Cl
InChIInChI=1S/C7H7ClF2N2O3S/c1-15-7-5(16(8,13)14)4(11)3(2-12-7)6(9)10/h2,6H,1H3,(H2,11,12)
InChIKeyZXOLJYQSCWDFER-UHFFFAOYSA-N
MW272.66 g/mol
LogP1.54
Rot. Bonds3

About 4-amino-5-(difluoromethyl)-2-methoxypyridine-3-sulfonyl chloride

4-amino-5-(difluoromethyl)-2-methoxypyridine-3-sulfonyl chloride (PubChem CID 118817786) has the molecular formula C7H7ClF2N2O3S and a molecular weight of 272.66 g/mol. Its IUPAC name is 4-amino-5-(difluoromethyl)-2-methoxypyridine-3-sulfonyl chloride.

Molecular Properties

Compound Name4-amino-5-(difluoromethyl)-2-methoxypyridine-3-sulfonyl chloride
PubChem CID118817786
Molecular FormulaC7H7ClF2N2O3S
Molecular Weight272.66 g/mol
Exact Mass271.98
IUPAC Name4-amino-5-(difluoromethyl)-2-methoxypyridine-3-sulfonyl chloride
SMILESCOc1ncc(C(F)F)c(N)c1S(=O)(=O)Cl
InChIInChI=1S/C7H7ClF2N2O3S/c1-15-7-5(16(8,13)14)4(11)3(2-12-7)6(9)10/h2,6H,1H3,(H2,11,12)
InChIKeyZXOLJYQSCWDFER-UHFFFAOYSA-N
XLogP1.54
TPSA82.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.66
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-amino-5-(difluoromethyl)-2-methylpyridine-3-sulfonyl chloride
CID 118800549
4-cyano-5-(difluoromethyl)-2-methoxypyridine-3-sulfonyl chloride
CID 118844670
4-amino-2-bromo-5-(difluoromethyl)pyridine-3-sulfonyl chloride
CID 118850596
3-(difluoromethyl)-2-methoxy-5-methylpyridine-4-sulfonyl chloride
CID 130088007
5-(difluoromethyl)-3-iodo-2-methoxypyridin-4-amine
CID 118806527
2-chloro-5-(difluoromethyl)-4-methoxypyridine-3-sulfonyl chloride
CID 130073994
3,4-dichloro-5-(difluoromethyl)-2-methoxypyridine
CID 130099248
4-bromo-5-(difluoromethyl)-6-methoxypyridine-3-sulfonyl chloride
CID 118828945
3-chloro-5-(difluoromethyl)-4-methoxypyridine-2-sulfonyl chloride
CID 130074018
3-chloro-5-(difluoromethyl)-2,4-dimethoxypyridine
CID 130100817
4-(difluoromethyl)-5,6-dimethoxypyridine-2-sulfonyl chloride
CID 118824318
3-(difluoromethyl)-2,5-dimethoxypyridine-4-sulfonamide
CID 134670782

Frequently Asked Questions

What is the IUPAC name of 4-amino-5-(difluoromethyl)-2-methoxypyridine-3-sulfonyl chloride?
The IUPAC name of 4-amino-5-(difluoromethyl)-2-methoxypyridine-3-sulfonyl chloride (CID 118817786) is 4-amino-5-(difluoromethyl)-2-methoxypyridine-3-sulfonyl chloride.
What is the SMILES notation for 4-amino-5-(difluoromethyl)-2-methoxypyridine-3-sulfonyl chloride?
The canonical SMILES for 4-amino-5-(difluoromethyl)-2-methoxypyridine-3-sulfonyl chloride is COc1ncc(C(F)F)c(N)c1S(=O)(=O)Cl.
What is the InChIKey of 4-amino-5-(difluoromethyl)-2-methoxypyridine-3-sulfonyl chloride?
The InChIKey is ZXOLJYQSCWDFER-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7ClF2N2O3S/c1-15-7-5(16(8,13)14)4(11)3(2-12-7)6(9)10/h2,6H,1H3,(H2,11,12).
What are the key properties of 4-amino-5-(difluoromethyl)-2-methoxypyridine-3-sulfonyl chloride?
4-amino-5-(difluoromethyl)-2-methoxypyridine-3-sulfonyl chloride has a molecular weight of 272.66 g/mol, XLogP of 1.54, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-(difluoromethyl)-2-methoxypyridine-3-sulfonyl chloride is sourced from PubChem (CID 118817786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).