2-(benzenesulfonyl)-4,6-dimethylthieno[2,3-b]pyridin-3-amine

C15H14N2O2S2 — CID 629125

IUPAC2-(benzenesulfonyl)-4,6-dimethylthieno[2,3-b]pyridin-3-amine
SMILESCc1cc(C)c2c(N)c(S(=O)(=O)c3ccccc3)sc2n1
InChIInChI=1S/C15H14N2O2S2/c1-9-8-10(2)17-14-12(9)13(16)15(20-14)21(18,19)11-6-4-3-5-7-11/h3-8H,16H2,1-2H3
InChIKeyUEHDDFIWOAZFQF-UHFFFAOYSA-N
MW318.42 g/mol
LogP3.33
Rot. Bonds2

About 2-(benzenesulfonyl)-4,6-dimethylthieno[2,3-b]pyridin-3-amine

2-(benzenesulfonyl)-4,6-dimethylthieno[2,3-b]pyridin-3-amine (PubChem CID 629125) has the molecular formula C15H14N2O2S2 and a molecular weight of 318.42 g/mol. Its IUPAC name is 2-(benzenesulfonyl)-4,6-dimethylthieno[2,3-b]pyridin-3-amine.

Molecular Properties

Compound Name2-(benzenesulfonyl)-4,6-dimethylthieno[2,3-b]pyridin-3-amine
PubChem CID629125
Molecular FormulaC15H14N2O2S2
Molecular Weight318.42 g/mol
Exact Mass318.05
IUPAC Name2-(benzenesulfonyl)-4,6-dimethylthieno[2,3-b]pyridin-3-amine
SMILESCc1cc(C)c2c(N)c(S(=O)(=O)c3ccccc3)sc2n1
InChIInChI=1S/C15H14N2O2S2/c1-9-8-10(2)17-14-12(9)13(16)15(20-14)21(18,19)11-6-4-3-5-7-11/h3-8H,16H2,1-2H3
InChIKeyUEHDDFIWOAZFQF-UHFFFAOYSA-N
XLogP3.33
TPSA73.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.42
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(Butane-1-sulfinyl)-4-phenyl-6-(thiophen-2-yl)thieno(2,3-b)pyridin-3-amine
CID 3337839
2-Butylsulfinyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-amine
CID 72188205
3-Amino-6-methylthieno[2,3-b]pyridine-2-carbonitrile
CID 702313
2-(Butane-1-sulfonyl)-4-phenyl-6-(thiophen-2-YL)thieno[2,3-B]pyridin-3-amine
CID 3337991
4,6-Dimethyl-2-(octylsulfinyl)thieno[2,3-b]pyridin-3-amine
CID 1717706
2-(Octylsulfinyl)-5,6,7,8-tetrahydrothieno[2,3-b]quinolin-3-amine
CID 4001738
2-Methanesulfonyl-4-phenyl-6-thiophen-2-yl-thieno[2,3-b]pyridin-3-ylamine
CID 654955
6-(4-Methylphenyl)-2-(methylsulfonyl)-4-phenylthieno[2,3-b]pyridin-3-amine
CID 1316236
4-Thio-7-methyl-1,2,3-triazino[4',5'-4,5]thiopheno[2,3-b]pyridine
CID 3000839
US9790233, ID SW208079
CID 3337838
2-Pentylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-amine
CID 72188203
2-Hexylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-amine
CID 72188204

Frequently Asked Questions

What is the IUPAC name of 2-(benzenesulfonyl)-4,6-dimethylthieno[2,3-b]pyridin-3-amine?
The IUPAC name of 2-(benzenesulfonyl)-4,6-dimethylthieno[2,3-b]pyridin-3-amine (CID 629125) is 2-(benzenesulfonyl)-4,6-dimethylthieno[2,3-b]pyridin-3-amine.
What is the SMILES notation for 2-(benzenesulfonyl)-4,6-dimethylthieno[2,3-b]pyridin-3-amine?
The canonical SMILES for 2-(benzenesulfonyl)-4,6-dimethylthieno[2,3-b]pyridin-3-amine is Cc1cc(C)c2c(N)c(S(=O)(=O)c3ccccc3)sc2n1.
What is the InChIKey of 2-(benzenesulfonyl)-4,6-dimethylthieno[2,3-b]pyridin-3-amine?
The InChIKey is UEHDDFIWOAZFQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O2S2/c1-9-8-10(2)17-14-12(9)13(16)15(20-14)21(18,19)11-6-4-3-5-7-11/h3-8H,16H2,1-2H3.
What are the key properties of 2-(benzenesulfonyl)-4,6-dimethylthieno[2,3-b]pyridin-3-amine?
2-(benzenesulfonyl)-4,6-dimethylthieno[2,3-b]pyridin-3-amine has a molecular weight of 318.42 g/mol, XLogP of 3.33, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzenesulfonyl)-4,6-dimethylthieno[2,3-b]pyridin-3-amine is sourced from PubChem (CID 629125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).