1-thiophen-2-ylsulfonylpyrrolidin-3-amine

C8H12N2O2S2 — CID 62069517

IUPAC1-thiophen-2-ylsulfonylpyrrolidin-3-amine
SMILESNC1CCN(S(=O)(=O)c2cccs2)C1
InChIInChI=1S/C8H12N2O2S2/c9-7-3-4-10(6-7)14(11,12)8-2-1-5-13-8/h1-2,5,7H,3-4,6,9H2
InChIKeyPEWRSEANKRIOCW-UHFFFAOYSA-N
MW232.33 g/mol
LogP0.47
Rot. Bonds2

About 1-thiophen-2-ylsulfonylpyrrolidin-3-amine

1-thiophen-2-ylsulfonylpyrrolidin-3-amine (PubChem CID 62069517) has the molecular formula C8H12N2O2S2 and a molecular weight of 232.33 g/mol. Its IUPAC name is 1-thiophen-2-ylsulfonylpyrrolidin-3-amine.

Molecular Properties

Compound Name1-thiophen-2-ylsulfonylpyrrolidin-3-amine
PubChem CID62069517
Molecular FormulaC8H12N2O2S2
Molecular Weight232.33 g/mol
Exact Mass232.03
IUPAC Name1-thiophen-2-ylsulfonylpyrrolidin-3-amine
SMILESNC1CCN(S(=O)(=O)c2cccs2)C1
InChIInChI=1S/C8H12N2O2S2/c9-7-3-4-10(6-7)14(11,12)8-2-1-5-13-8/h1-2,5,7H,3-4,6,9H2
InChIKeyPEWRSEANKRIOCW-UHFFFAOYSA-N
XLogP0.47
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-methyl-1-thiophen-2-ylsulfonylpiperidin-4-amine;hydrochloride
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(4-methyl-1-thiophen-2-ylsulfonylpiperidin-3-yl)methanamine
CID 114960944
1-(5-methylthiophen-2-yl)sulfonylpyrrolidin-3-amine
CID 62067377
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CID 49246031
2-methyl-1-thiophen-2-ylsulfonylpiperidin-4-amine
CID 115312618
N-[[(3R)-1-thiophen-2-ylsulfonylpyrrolidin-3-yl]methyl]ethenesulfonamide
CID 146210607
3-[(3R)-1-thiophen-2-ylsulfonylpyrrolidin-3-yl]-1,3-oxazolidine-2,4-dione
CID 100728515
1-cyclopropyl-4-thiophen-2-ylsulfonylpiperazine
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1-thiophen-2-ylsulfonylpiperidine
CID 765823
(3S)-1-(5-methylthiophen-2-yl)sulfonylpyrrolidin-3-amine;hydrochloride
CID 119993403
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CID 119971533

Frequently Asked Questions

What is the IUPAC name of 1-thiophen-2-ylsulfonylpyrrolidin-3-amine?
The IUPAC name of 1-thiophen-2-ylsulfonylpyrrolidin-3-amine (CID 62069517) is 1-thiophen-2-ylsulfonylpyrrolidin-3-amine.
What is the SMILES notation for 1-thiophen-2-ylsulfonylpyrrolidin-3-amine?
The canonical SMILES for 1-thiophen-2-ylsulfonylpyrrolidin-3-amine is NC1CCN(S(=O)(=O)c2cccs2)C1.
What is the InChIKey of 1-thiophen-2-ylsulfonylpyrrolidin-3-amine?
The InChIKey is PEWRSEANKRIOCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O2S2/c9-7-3-4-10(6-7)14(11,12)8-2-1-5-13-8/h1-2,5,7H,3-4,6,9H2.
What are the key properties of 1-thiophen-2-ylsulfonylpyrrolidin-3-amine?
1-thiophen-2-ylsulfonylpyrrolidin-3-amine has a molecular weight of 232.33 g/mol, XLogP of 0.47, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-thiophen-2-ylsulfonylpyrrolidin-3-amine is sourced from PubChem (CID 62069517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).