3,5-dichloro-6-(3-methylsulfonylphenoxy)pyridin-2-amine

C12H10Cl2N2O3S — CID 102760799

IUPAC3,5-dichloro-6-(3-methylsulfonylphenoxy)pyridin-2-amine
SMILESCS(=O)(=O)c1cccc(Oc2nc(N)c(Cl)cc2Cl)c1
InChIInChI=1S/C12H10Cl2N2O3S/c1-20(17,18)8-4-2-3-7(5-8)19-12-10(14)6-9(13)11(15)16-12/h2-6H,1H3,(H2,15,16)
InChIKeyFXSVXTMMIGIEKX-UHFFFAOYSA-N
MW333.20 g/mol
LogP3.17
Rot. Bonds3

About 3,5-dichloro-6-(3-methylsulfonylphenoxy)pyridin-2-amine

3,5-dichloro-6-(3-methylsulfonylphenoxy)pyridin-2-amine (PubChem CID 102760799) has the molecular formula C12H10Cl2N2O3S and a molecular weight of 333.20 g/mol. Its IUPAC name is 3,5-dichloro-6-(3-methylsulfonylphenoxy)pyridin-2-amine.

Molecular Properties

Compound Name3,5-dichloro-6-(3-methylsulfonylphenoxy)pyridin-2-amine
PubChem CID102760799
Molecular FormulaC12H10Cl2N2O3S
Molecular Weight333.20 g/mol
Exact Mass331.98
IUPAC Name3,5-dichloro-6-(3-methylsulfonylphenoxy)pyridin-2-amine
SMILESCS(=O)(=O)c1cccc(Oc2nc(N)c(Cl)cc2Cl)c1
InChIInChI=1S/C12H10Cl2N2O3S/c1-20(17,18)8-4-2-3-7(5-8)19-12-10(14)6-9(13)11(15)16-12/h2-6H,1H3,(H2,15,16)
InChIKeyFXSVXTMMIGIEKX-UHFFFAOYSA-N
XLogP3.17
TPSA82.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.20
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-chloro-5-(chloromethyl)-2-(3-methylsulfonylphenoxy)pyridine
CID 61267710
[5-chloro-6-(3-methylsulfonylphenoxy)-3-pyridinyl]methanol
CID 61256942
5-chloro-2-(3-methylsulfonylphenoxy)aniline
CID 43806849
3-chloro-6-(3-methylsulfonylphenoxy)pyridazine
CID 54915361
5-amino-2-(3-methylsulfonylphenoxy)pyridine-3-carbonitrile
CID 60924024
8-(3-methylsulfonylphenoxy)imidazo[1,2-a]pyrazin-6-amine
CID 80874626
2-chloro-6-(3-methylsulfonylphenoxy)benzaldehyde
CID 43807103
3-chloro-2-(3-methylsulfonylphenoxy)pyridine-4-carboxylic acid
CID 107063434
4-chloro-6-(3-methylsulfonylphenoxy)-2-propan-2-ylpyrimidine
CID 80944929
(2-amino-3-chlorophenyl)-[3-(3-methylsulfonylphenoxy)phenyl]methanone
CID 68670033
3-chloro-2-[(3-methylsulfonylphenoxy)methyl]aniline
CID 63746458
[3,5-dichloro-6-(4-methylsulfonylphenoxy)-2-pyridinyl]hydrazine
CID 102762928

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-6-(3-methylsulfonylphenoxy)pyridin-2-amine?
The IUPAC name of 3,5-dichloro-6-(3-methylsulfonylphenoxy)pyridin-2-amine (CID 102760799) is 3,5-dichloro-6-(3-methylsulfonylphenoxy)pyridin-2-amine.
What is the SMILES notation for 3,5-dichloro-6-(3-methylsulfonylphenoxy)pyridin-2-amine?
The canonical SMILES for 3,5-dichloro-6-(3-methylsulfonylphenoxy)pyridin-2-amine is CS(=O)(=O)c1cccc(Oc2nc(N)c(Cl)cc2Cl)c1.
What is the InChIKey of 3,5-dichloro-6-(3-methylsulfonylphenoxy)pyridin-2-amine?
The InChIKey is FXSVXTMMIGIEKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10Cl2N2O3S/c1-20(17,18)8-4-2-3-7(5-8)19-12-10(14)6-9(13)11(15)16-12/h2-6H,1H3,(H2,15,16).
What are the key properties of 3,5-dichloro-6-(3-methylsulfonylphenoxy)pyridin-2-amine?
3,5-dichloro-6-(3-methylsulfonylphenoxy)pyridin-2-amine has a molecular weight of 333.20 g/mol, XLogP of 3.17, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-6-(3-methylsulfonylphenoxy)pyridin-2-amine is sourced from PubChem (CID 102760799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).