2-(thiophen-3-ylmethylsulfonyl)pyridin-3-amine

C10H10N2O2S2 — CID 61369370

IUPAC2-(thiophen-3-ylmethylsulfonyl)pyridin-3-amine
SMILESNc1cccnc1S(=O)(=O)Cc1ccsc1
InChIInChI=1S/C10H10N2O2S2/c11-9-2-1-4-12-10(9)16(13,14)7-8-3-5-15-6-8/h1-6H,7,11H2
InChIKeyUKOFDFGIQMBFJC-UHFFFAOYSA-N
MW254.34 g/mol
LogP1.70
Rot. Bonds3

About 2-(thiophen-3-ylmethylsulfonyl)pyridin-3-amine

2-(thiophen-3-ylmethylsulfonyl)pyridin-3-amine (PubChem CID 61369370) has the molecular formula C10H10N2O2S2 and a molecular weight of 254.34 g/mol. Its IUPAC name is 2-(thiophen-3-ylmethylsulfonyl)pyridin-3-amine.

Molecular Properties

Compound Name2-(thiophen-3-ylmethylsulfonyl)pyridin-3-amine
PubChem CID61369370
Molecular FormulaC10H10N2O2S2
Molecular Weight254.34 g/mol
Exact Mass254.02
IUPAC Name2-(thiophen-3-ylmethylsulfonyl)pyridin-3-amine
SMILESNc1cccnc1S(=O)(=O)Cc1ccsc1
InChIInChI=1S/C10H10N2O2S2/c11-9-2-1-4-12-10(9)16(13,14)7-8-3-5-15-6-8/h1-6H,7,11H2
InChIKeyUKOFDFGIQMBFJC-UHFFFAOYSA-N
XLogP1.70
TPSA73.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.34
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(thiophen-3-ylmethylsulfonyl)pyridin-3-amine?
The IUPAC name of 2-(thiophen-3-ylmethylsulfonyl)pyridin-3-amine (CID 61369370) is 2-(thiophen-3-ylmethylsulfonyl)pyridin-3-amine.
What is the SMILES notation for 2-(thiophen-3-ylmethylsulfonyl)pyridin-3-amine?
The canonical SMILES for 2-(thiophen-3-ylmethylsulfonyl)pyridin-3-amine is Nc1cccnc1S(=O)(=O)Cc1ccsc1.
What is the InChIKey of 2-(thiophen-3-ylmethylsulfonyl)pyridin-3-amine?
The InChIKey is UKOFDFGIQMBFJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O2S2/c11-9-2-1-4-12-10(9)16(13,14)7-8-3-5-15-6-8/h1-6H,7,11H2.
What are the key properties of 2-(thiophen-3-ylmethylsulfonyl)pyridin-3-amine?
2-(thiophen-3-ylmethylsulfonyl)pyridin-3-amine has a molecular weight of 254.34 g/mol, XLogP of 1.70, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(thiophen-3-ylmethylsulfonyl)pyridin-3-amine is sourced from PubChem (CID 61369370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).