(5-thiophen-2-ylsulfonylthiophen-2-yl)methanamine

C9H9NO2S3 — CID 130345103

IUPAC(5-thiophen-2-ylsulfonylthiophen-2-yl)methanamine
SMILESNCc1ccc(S(=O)(=O)c2cccs2)s1
InChIInChI=1S/C9H9NO2S3/c10-6-7-3-4-9(14-7)15(11,12)8-2-1-5-13-8/h1-5H,6,10H2
InChIKeyZTHKYTCZHRLTGD-UHFFFAOYSA-N
MW259.38 g/mol
LogP2.10
Rot. Bonds3

About (5-thiophen-2-ylsulfonylthiophen-2-yl)methanamine

(5-thiophen-2-ylsulfonylthiophen-2-yl)methanamine (PubChem CID 130345103) has the molecular formula C9H9NO2S3 and a molecular weight of 259.38 g/mol. Its IUPAC name is (5-thiophen-2-ylsulfonylthiophen-2-yl)methanamine.

Molecular Properties

Compound Name(5-thiophen-2-ylsulfonylthiophen-2-yl)methanamine
PubChem CID130345103
Molecular FormulaC9H9NO2S3
Molecular Weight259.38 g/mol
Exact Mass258.98
IUPAC Name(5-thiophen-2-ylsulfonylthiophen-2-yl)methanamine
SMILESNCc1ccc(S(=O)(=O)c2cccs2)s1
InChIInChI=1S/C9H9NO2S3/c10-6-7-3-4-9(14-7)15(11,12)8-2-1-5-13-8/h1-5H,6,10H2
InChIKeyZTHKYTCZHRLTGD-UHFFFAOYSA-N
XLogP2.10
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.38
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (5-thiophen-2-ylsulfonylthiophen-2-yl)methanamine?
The IUPAC name of (5-thiophen-2-ylsulfonylthiophen-2-yl)methanamine (CID 130345103) is (5-thiophen-2-ylsulfonylthiophen-2-yl)methanamine.
What is the SMILES notation for (5-thiophen-2-ylsulfonylthiophen-2-yl)methanamine?
The canonical SMILES for (5-thiophen-2-ylsulfonylthiophen-2-yl)methanamine is NCc1ccc(S(=O)(=O)c2cccs2)s1.
What is the InChIKey of (5-thiophen-2-ylsulfonylthiophen-2-yl)methanamine?
The InChIKey is ZTHKYTCZHRLTGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9NO2S3/c10-6-7-3-4-9(14-7)15(11,12)8-2-1-5-13-8/h1-5H,6,10H2.
What are the key properties of (5-thiophen-2-ylsulfonylthiophen-2-yl)methanamine?
(5-thiophen-2-ylsulfonylthiophen-2-yl)methanamine has a molecular weight of 259.38 g/mol, XLogP of 2.10, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5-thiophen-2-ylsulfonylthiophen-2-yl)methanamine is sourced from PubChem (CID 130345103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).