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

C10H18N4O2S2 — CID 172893524

IUPACN-methyl-N-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-3-yl]methanesulfonamide
SMILESCc1nnc(N2CCCC(N(C)S(C)(=O)=O)C2)s1
InChIInChI=1S/C10H18N4O2S2/c1-8-11-12-10(17-8)14-6-4-5-9(7-14)13(2)18(3,15)16/h9H,4-7H2,1-3H3
InChIKeyMBLIBSJHEPUMEU-UHFFFAOYSA-N
MW290.41 g/mol
LogP0.71
Rot. Bonds3

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

N-methyl-N-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-3-yl]methanesulfonamide (PubChem CID 172893524) has the molecular formula C10H18N4O2S2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-methyl-N-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-3-yl]methanesulfonamide.

Molecular Properties

Compound NameN-methyl-N-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-3-yl]methanesulfonamide
PubChem CID172893524
Molecular FormulaC10H18N4O2S2
Molecular Weight290.41 g/mol
Exact Mass290.09
IUPAC NameN-methyl-N-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-3-yl]methanesulfonamide
SMILESCc1nnc(N2CCCC(N(C)S(C)(=O)=O)C2)s1
InChIInChI=1S/C10H18N4O2S2/c1-8-11-12-10(17-8)14-6-4-5-9(7-14)13(2)18(3,15)16/h9H,4-7H2,1-3H3
InChIKeyMBLIBSJHEPUMEU-UHFFFAOYSA-N
XLogP0.71
TPSA66.40 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 50.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

N,5-dimethyl-N-[[(2R)-1-methylpiperidin-2-yl]methyl]-1,3,4-thiadiazol-2-amine
CID 125527689
N-[1-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]piperidin-3-yl]methanesulfonamide
CID 91661710
N-[(3R)-1-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]piperidin-3-yl]methanesulfonamide
CID 99630904
N-[(3S)-1-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]piperidin-3-yl]methanesulfonamide
CID 99630906
N-cyclopentyl-1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidine-3-sulfonamide
CID 75504400
5-[(4-methylsulfonylpiperazin-1-yl)methyl]-N-propyl-1,3,4-thiadiazol-2-amine
CID 80606524
N-[1-(5-Tert-butyl-1,3,4-thiadiazol-2-YL)piperidin-3-YL]methanesulfonamide
CID 86802983
N-[(3S)-1-(5-tert-butyl-1,3,4-thiadiazol-2-yl)piperidin-3-yl]methanesulfonamide
CID 97820486
N-[(3R)-1-(5-tert-butyl-1,3,4-thiadiazol-2-yl)piperidin-3-yl]methanesulfonamide
CID 97820487
(3S)-N-cyclopentyl-1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidine-3-sulfonamide
CID 97823781
(3R)-N-cyclopentyl-1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidine-3-sulfonamide
CID 97823783
2-(4-Butylsulfonylpiperazin-1-yl)-5-methyl-1,3,4-thiadiazole
CID 108780876

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-3-yl]methanesulfonamide?
The IUPAC name of N-methyl-N-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-3-yl]methanesulfonamide (CID 172893524) is N-methyl-N-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-3-yl]methanesulfonamide.
What is the SMILES notation for N-methyl-N-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-3-yl]methanesulfonamide?
The canonical SMILES for N-methyl-N-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-3-yl]methanesulfonamide is Cc1nnc(N2CCCC(N(C)S(C)(=O)=O)C2)s1.
What is the InChIKey of N-methyl-N-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-3-yl]methanesulfonamide?
The InChIKey is MBLIBSJHEPUMEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O2S2/c1-8-11-12-10(17-8)14-6-4-5-9(7-14)13(2)18(3,15)16/h9H,4-7H2,1-3H3.
What are the key properties of N-methyl-N-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-3-yl]methanesulfonamide?
N-methyl-N-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-3-yl]methanesulfonamide has a molecular weight of 290.41 g/mol, XLogP of 0.71, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-3-yl]methanesulfonamide is sourced from PubChem (CID 172893524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).