5-pyrrolidin-1-ylsulfonyl-1,3,4-thiadiazol-2-amine

C6H10N4O2S2 — CID 82083105

IUPAC5-pyrrolidin-1-ylsulfonyl-1,3,4-thiadiazol-2-amine
SMILESNc1nnc(S(=O)(=O)N2CCCC2)s1
InChIInChI=1S/C6H10N4O2S2/c7-5-8-9-6(13-5)14(11,12)10-3-1-2-4-10/h1-4H2,(H2,7,8)
InChIKeyUIUCGFLHSLAVJN-UHFFFAOYSA-N
MW234.31 g/mol
LogP-0.10
Rot. Bonds2

About 5-pyrrolidin-1-ylsulfonyl-1,3,4-thiadiazol-2-amine

5-pyrrolidin-1-ylsulfonyl-1,3,4-thiadiazol-2-amine (PubChem CID 82083105) has the molecular formula C6H10N4O2S2 and a molecular weight of 234.31 g/mol. Its IUPAC name is 5-pyrrolidin-1-ylsulfonyl-1,3,4-thiadiazol-2-amine.

Molecular Properties

Compound Name5-pyrrolidin-1-ylsulfonyl-1,3,4-thiadiazol-2-amine
PubChem CID82083105
Molecular FormulaC6H10N4O2S2
Molecular Weight234.31 g/mol
Exact Mass234.02
IUPAC Name5-pyrrolidin-1-ylsulfonyl-1,3,4-thiadiazol-2-amine
SMILESNc1nnc(S(=O)(=O)N2CCCC2)s1
InChIInChI=1S/C6H10N4O2S2/c7-5-8-9-6(13-5)14(11,12)10-3-1-2-4-10/h1-4H2,(H2,7,8)
InChIKeyUIUCGFLHSLAVJN-UHFFFAOYSA-N
XLogP-0.10
TPSA89.18 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.31
LogP ≤ 5-0.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-(4-methylpiperidin-1-yl)sulfonyl-1,3,4-thiadiazol-2-amine
CID 82090856
2-[1-[(5-amino-1,3,4-thiadiazol-2-yl)sulfonyl]pyrrolidin-3-yl]ethanol
CID 114798318
N-(5-piperidin-1-ylsulfonyl-1,3,4-thiadiazol-2-yl)acetamide
CID 56919403
5-(4-piperidin-1-ylsulfonyl-1,4-diazepan-1-yl)-1,3,4-thiadiazol-2-amine
CID 146043275
2,4-dichloro-N-(5-piperidin-1-ylsulfonyl-1,3,4-thiadiazol-2-yl)benzamide
CID 100538861
N-(5-morpholin-4-ylsulfonyl-1,3,4-thiadiazol-2-yl)cyclohexanecarboxamide
CID 22517558
2,4-dimethyl-5-pyrrolidin-1-ylsulfonyl-1,3-thiazole
CID 127408516
4-methyl-5-(1,4-thiazepan-4-ylsulfonyl)-1,3-thiazol-2-amine
CID 63946602
5-pyrrolidin-1-ylsulfonylpyridin-3-amine
CID 82222980
N-[5-(1,3-oxazinan-3-ylsulfonyl)-1,3,4-thiadiazol-2-yl]acetamide
CID 110739746
5-[(2-chloro-6-fluorophenyl)methylsulfonyl]-1,3,4-thiadiazol-2-amine
CID 122157809
2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)acetamide
CID 4033873

Frequently Asked Questions

What is the IUPAC name of 5-pyrrolidin-1-ylsulfonyl-1,3,4-thiadiazol-2-amine?
The IUPAC name of 5-pyrrolidin-1-ylsulfonyl-1,3,4-thiadiazol-2-amine (CID 82083105) is 5-pyrrolidin-1-ylsulfonyl-1,3,4-thiadiazol-2-amine.
What is the SMILES notation for 5-pyrrolidin-1-ylsulfonyl-1,3,4-thiadiazol-2-amine?
The canonical SMILES for 5-pyrrolidin-1-ylsulfonyl-1,3,4-thiadiazol-2-amine is Nc1nnc(S(=O)(=O)N2CCCC2)s1.
What is the InChIKey of 5-pyrrolidin-1-ylsulfonyl-1,3,4-thiadiazol-2-amine?
The InChIKey is UIUCGFLHSLAVJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N4O2S2/c7-5-8-9-6(13-5)14(11,12)10-3-1-2-4-10/h1-4H2,(H2,7,8).
What are the key properties of 5-pyrrolidin-1-ylsulfonyl-1,3,4-thiadiazol-2-amine?
5-pyrrolidin-1-ylsulfonyl-1,3,4-thiadiazol-2-amine has a molecular weight of 234.31 g/mol, XLogP of -0.10, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pyrrolidin-1-ylsulfonyl-1,3,4-thiadiazol-2-amine is sourced from PubChem (CID 82083105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).