N-[1-(5-amino-1,3,4-thiadiazol-2-yl)piperidin-4-yl]methanesulfonamide

C8H15N5O2S2 — CID 146046523

IUPACN-[1-(5-amino-1,3,4-thiadiazol-2-yl)piperidin-4-yl]methanesulfonamide
SMILESCS(=O)(=O)NC1CCN(c2nnc(N)s2)CC1
InChIInChI=1S/C8H15N5O2S2/c1-17(14,15)12-6-2-4-13(5-3-6)8-11-10-7(9)16-8/h6,12H,2-5H2,1H3,(H2,9,10)
InChIKeyFFXIHFHUGFAWLT-UHFFFAOYSA-N
MW277.38 g/mol
LogP-0.36
Rot. Bonds3

About N-[1-(5-amino-1,3,4-thiadiazol-2-yl)piperidin-4-yl]methanesulfonamide

N-[1-(5-amino-1,3,4-thiadiazol-2-yl)piperidin-4-yl]methanesulfonamide (PubChem CID 146046523) has the molecular formula C8H15N5O2S2 and a molecular weight of 277.38 g/mol. Its IUPAC name is N-[1-(5-amino-1,3,4-thiadiazol-2-yl)piperidin-4-yl]methanesulfonamide.

Molecular Properties

Compound NameN-[1-(5-amino-1,3,4-thiadiazol-2-yl)piperidin-4-yl]methanesulfonamide
PubChem CID146046523
Molecular FormulaC8H15N5O2S2
Molecular Weight277.38 g/mol
Exact Mass277.07
IUPAC NameN-[1-(5-amino-1,3,4-thiadiazol-2-yl)piperidin-4-yl]methanesulfonamide
SMILESCS(=O)(=O)NC1CCN(c2nnc(N)s2)CC1
InChIInChI=1S/C8H15N5O2S2/c1-17(14,15)12-6-2-4-13(5-3-6)8-11-10-7(9)16-8/h6,12H,2-5H2,1H3,(H2,9,10)
InChIKeyFFXIHFHUGFAWLT-UHFFFAOYSA-N
XLogP-0.36
TPSA101.21 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.38
LogP ≤ 5-0.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

1-(5-amino-1,3,4-thiadiazol-2-yl)piperidin-4-ol
CID 68709720
1-(5-amino-1,3,4-thiadiazol-2-yl)piperidine-4-carboxylic acid
CID 6917210
N-[1-(5-methylpyrimidin-2-yl)piperidin-4-yl]methanesulfonamide
CID 118640013
5-(4-piperidin-1-ylsulfonyl-1,4-diazepan-1-yl)-1,3,4-thiadiazol-2-amine
CID 146043275
N-[1-(6-tert-butylpyridazin-3-yl)piperidin-4-yl]methanesulfonamide
CID 165434698
N-[1-[5-[6-amino-5-(trifluoromethyl)-3-pyridinyl]imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperidin-4-yl]methanesulfonamide
CID 66748617
N-[1-(2-amino-6-propan-2-yloxypyrimidin-4-yl)piperidin-4-yl]methanesulfonamide
CID 50982057
N-[1-(2-amino-7H-purin-6-yl)piperidin-4-yl]methanesulfonamide
CID 72881722
N-[1-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)piperidin-4-yl]methanesulfonamide
CID 41332420
5-[(3R)-3-[(5-amino-1,3,4-thiadiazol-2-yl)oxy]pyrrolidin-1-yl]-1,3,4-thiadiazol-2-amine
CID 121256433
N-[1-[6-[6-amino-5-(trifluoromethyl)-3-pyridinyl]imidazo[2,1-b][1,3,4]thiadiazol-2-yl]piperidin-4-yl]methanesulfonamide
CID 66748618
1-(5-amino-1,3,4-thiadiazol-2-yl)piperidine-3-carboxylic acid
CID 122172593

Frequently Asked Questions

What is the IUPAC name of N-[1-(5-amino-1,3,4-thiadiazol-2-yl)piperidin-4-yl]methanesulfonamide?
The IUPAC name of N-[1-(5-amino-1,3,4-thiadiazol-2-yl)piperidin-4-yl]methanesulfonamide (CID 146046523) is N-[1-(5-amino-1,3,4-thiadiazol-2-yl)piperidin-4-yl]methanesulfonamide.
What is the SMILES notation for N-[1-(5-amino-1,3,4-thiadiazol-2-yl)piperidin-4-yl]methanesulfonamide?
The canonical SMILES for N-[1-(5-amino-1,3,4-thiadiazol-2-yl)piperidin-4-yl]methanesulfonamide is CS(=O)(=O)NC1CCN(c2nnc(N)s2)CC1.
What is the InChIKey of N-[1-(5-amino-1,3,4-thiadiazol-2-yl)piperidin-4-yl]methanesulfonamide?
The InChIKey is FFXIHFHUGFAWLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N5O2S2/c1-17(14,15)12-6-2-4-13(5-3-6)8-11-10-7(9)16-8/h6,12H,2-5H2,1H3,(H2,9,10).
What are the key properties of N-[1-(5-amino-1,3,4-thiadiazol-2-yl)piperidin-4-yl]methanesulfonamide?
N-[1-(5-amino-1,3,4-thiadiazol-2-yl)piperidin-4-yl]methanesulfonamide has a molecular weight of 277.38 g/mol, XLogP of -0.36, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-amino-1,3,4-thiadiazol-2-yl)piperidin-4-yl]methanesulfonamide is sourced from PubChem (CID 146046523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).