N-cyclopentyl-1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidine-3-sulfonamide

C13H22N4O2S2 — CID 75504400

IUPACN-cyclopentyl-1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidine-3-sulfonamide
SMILESCc1nnc(N2CCCC(S(=O)(=O)NC3CCCC3)C2)s1
InChIInChI=1S/C13H22N4O2S2/c1-10-14-15-13(20-10)17-8-4-7-12(9-17)21(18,19)16-11-5-2-3-6-11/h11-12,16H,2-9H2,1H3
InChIKeyUATYDWJMZPEXPB-UHFFFAOYSA-N
MW330.48 g/mol
LogP1.68
Rot. Bonds4

About N-cyclopentyl-1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidine-3-sulfonamide

N-cyclopentyl-1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidine-3-sulfonamide (PubChem CID 75504400) has the molecular formula C13H22N4O2S2 and a molecular weight of 330.48 g/mol. Its IUPAC name is N-cyclopentyl-1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidine-3-sulfonamide.

Molecular Properties

Compound NameN-cyclopentyl-1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidine-3-sulfonamide
PubChem CID75504400
Molecular FormulaC13H22N4O2S2
Molecular Weight330.48 g/mol
Exact Mass330.12
IUPAC NameN-cyclopentyl-1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidine-3-sulfonamide
SMILESCc1nnc(N2CCCC(S(=O)(=O)NC3CCCC3)C2)s1
InChIInChI=1S/C13H22N4O2S2/c1-10-14-15-13(20-10)17-8-4-7-12(9-17)21(18,19)16-11-5-2-3-6-11/h11-12,16H,2-9H2,1H3
InChIKeyUATYDWJMZPEXPB-UHFFFAOYSA-N
XLogP1.68
TPSA75.19 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.48
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidine-3-sulfonamide?
The IUPAC name of N-cyclopentyl-1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidine-3-sulfonamide (CID 75504400) is N-cyclopentyl-1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidine-3-sulfonamide.
What is the SMILES notation for N-cyclopentyl-1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidine-3-sulfonamide?
The canonical SMILES for N-cyclopentyl-1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidine-3-sulfonamide is Cc1nnc(N2CCCC(S(=O)(=O)NC3CCCC3)C2)s1.
What is the InChIKey of N-cyclopentyl-1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidine-3-sulfonamide?
The InChIKey is UATYDWJMZPEXPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O2S2/c1-10-14-15-13(20-10)17-8-4-7-12(9-17)21(18,19)16-11-5-2-3-6-11/h11-12,16H,2-9H2,1H3.
What are the key properties of N-cyclopentyl-1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidine-3-sulfonamide?
N-cyclopentyl-1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidine-3-sulfonamide has a molecular weight of 330.48 g/mol, XLogP of 1.68, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidine-3-sulfonamide is sourced from PubChem (CID 75504400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).