5-fluoro-2-methyl-6-(1,2-oxazol-3-ylmethylsulfonyl)pyridin-3-amine

C10H10FN3O3S — CID 161161297

IUPAC5-fluoro-2-methyl-6-(1,2-oxazol-3-ylmethylsulfonyl)pyridin-3-amine
SMILESCc1nc(S(=O)(=O)Cc2ccon2)c(F)cc1N
InChIInChI=1S/C10H10FN3O3S/c1-6-9(12)4-8(11)10(13-6)18(15,16)5-7-2-3-17-14-7/h2-4H,5,12H2,1H3
InChIKeyUPYONLAPHRQRSP-UHFFFAOYSA-N
MW271.27 g/mol
LogP1.07
Rot. Bonds3

About 5-fluoro-2-methyl-6-(1,2-oxazol-3-ylmethylsulfonyl)pyridin-3-amine

5-fluoro-2-methyl-6-(1,2-oxazol-3-ylmethylsulfonyl)pyridin-3-amine (PubChem CID 161161297) has the molecular formula C10H10FN3O3S and a molecular weight of 271.27 g/mol. Its IUPAC name is 5-fluoro-2-methyl-6-(1,2-oxazol-3-ylmethylsulfonyl)pyridin-3-amine.

Molecular Properties

Compound Name5-fluoro-2-methyl-6-(1,2-oxazol-3-ylmethylsulfonyl)pyridin-3-amine
PubChem CID161161297
Molecular FormulaC10H10FN3O3S
Molecular Weight271.27 g/mol
Exact Mass271.04
IUPAC Name5-fluoro-2-methyl-6-(1,2-oxazol-3-ylmethylsulfonyl)pyridin-3-amine
SMILESCc1nc(S(=O)(=O)Cc2ccon2)c(F)cc1N
InChIInChI=1S/C10H10FN3O3S/c1-6-9(12)4-8(11)10(13-6)18(15,16)5-7-2-3-17-14-7/h2-4H,5,12H2,1H3
InChIKeyUPYONLAPHRQRSP-UHFFFAOYSA-N
XLogP1.07
TPSA99.08 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.27
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-methyl-6-(1,2-oxazol-3-ylmethylsulfonyl)pyridin-3-amine?
The IUPAC name of 5-fluoro-2-methyl-6-(1,2-oxazol-3-ylmethylsulfonyl)pyridin-3-amine (CID 161161297) is 5-fluoro-2-methyl-6-(1,2-oxazol-3-ylmethylsulfonyl)pyridin-3-amine.
What is the SMILES notation for 5-fluoro-2-methyl-6-(1,2-oxazol-3-ylmethylsulfonyl)pyridin-3-amine?
The canonical SMILES for 5-fluoro-2-methyl-6-(1,2-oxazol-3-ylmethylsulfonyl)pyridin-3-amine is Cc1nc(S(=O)(=O)Cc2ccon2)c(F)cc1N.
What is the InChIKey of 5-fluoro-2-methyl-6-(1,2-oxazol-3-ylmethylsulfonyl)pyridin-3-amine?
The InChIKey is UPYONLAPHRQRSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FN3O3S/c1-6-9(12)4-8(11)10(13-6)18(15,16)5-7-2-3-17-14-7/h2-4H,5,12H2,1H3.
What are the key properties of 5-fluoro-2-methyl-6-(1,2-oxazol-3-ylmethylsulfonyl)pyridin-3-amine?
5-fluoro-2-methyl-6-(1,2-oxazol-3-ylmethylsulfonyl)pyridin-3-amine has a molecular weight of 271.27 g/mol, XLogP of 1.07, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-methyl-6-(1,2-oxazol-3-ylmethylsulfonyl)pyridin-3-amine is sourced from PubChem (CID 161161297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).