4-(piperidin-4-ylmethyl)piperazine-1-sulfonamide

C10H22N4O2S — CID 119929956

IUPAC4-(piperidin-4-ylmethyl)piperazine-1-sulfonamide
SMILESNS(=O)(=O)N1CCN(CC2CCNCC2)CC1
InChIInChI=1S/C10H22N4O2S/c11-17(15,16)14-7-5-13(6-8-14)9-10-1-3-12-4-2-10/h10,12H,1-9H2,(H2,11,15,16)
InChIKeyZGGFZPMTVWQUCQ-UHFFFAOYSA-N
MW262.38 g/mol
LogP-1.19
Rot. Bonds3

About 4-(piperidin-4-ylmethyl)piperazine-1-sulfonamide

4-(piperidin-4-ylmethyl)piperazine-1-sulfonamide (PubChem CID 119929956) has the molecular formula C10H22N4O2S and a molecular weight of 262.38 g/mol. Its IUPAC name is 4-(piperidin-4-ylmethyl)piperazine-1-sulfonamide.

Molecular Properties

Compound Name4-(piperidin-4-ylmethyl)piperazine-1-sulfonamide
PubChem CID119929956
Molecular FormulaC10H22N4O2S
Molecular Weight262.38 g/mol
Exact Mass262.15
IUPAC Name4-(piperidin-4-ylmethyl)piperazine-1-sulfonamide
SMILESNS(=O)(=O)N1CCN(CC2CCNCC2)CC1
InChIInChI=1S/C10H22N4O2S/c11-17(15,16)14-7-5-13(6-8-14)9-10-1-3-12-4-2-10/h10,12H,1-9H2,(H2,11,15,16)
InChIKeyZGGFZPMTVWQUCQ-UHFFFAOYSA-N
XLogP-1.19
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.38
LogP ≤ 5-1.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-ethylsulfonyl-4-(piperidin-4-ylmethyl)piperazine;hydrochloride
CID 119930045
1,4-bis(piperidin-4-ylmethyl)piperazine
CID 18770387
1,4-bis(piperidin-4-ylmethyl)piperazine;tetrahydrochloride
CID 18770386
1-(3,4-dichlorophenyl)sulfonyl-4-(piperidin-4-ylmethyl)piperazine;hydrochloride
CID 119929370
1-(piperidin-4-ylmethyl)piperidin-4-one
CID 115020783
1-(piperidin-4-ylmethyl)-4-(2,2,2-trifluoroethyl)piperazine
CID 62967874
1-ethyl-4-(piperidin-4-ylmethylsulfonyl)piperazine
CID 54973856
N-methyl-3-[4-(piperidin-4-ylmethyl)piperazin-1-yl]propan-1-amine
CID 177055250
1-(2-nitrophenyl)sulfonyl-4-(piperidin-4-ylmethyl)piperazine;hydrochloride
CID 119929358
1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-(piperidin-4-ylmethyl)piperazine;hydrochloride
CID 119929368
1-(piperidin-4-ylmethyl)-4-[3-(trifluoromethyl)phenyl]sulfonylpiperazine;hydrochloride
CID 119929378
[1-(piperidin-4-ylmethyl)piperidin-4-yl]methyl carbamate
CID 175359661

Frequently Asked Questions

What is the IUPAC name of 4-(piperidin-4-ylmethyl)piperazine-1-sulfonamide?
The IUPAC name of 4-(piperidin-4-ylmethyl)piperazine-1-sulfonamide (CID 119929956) is 4-(piperidin-4-ylmethyl)piperazine-1-sulfonamide.
What is the SMILES notation for 4-(piperidin-4-ylmethyl)piperazine-1-sulfonamide?
The canonical SMILES for 4-(piperidin-4-ylmethyl)piperazine-1-sulfonamide is NS(=O)(=O)N1CCN(CC2CCNCC2)CC1.
What is the InChIKey of 4-(piperidin-4-ylmethyl)piperazine-1-sulfonamide?
The InChIKey is ZGGFZPMTVWQUCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N4O2S/c11-17(15,16)14-7-5-13(6-8-14)9-10-1-3-12-4-2-10/h10,12H,1-9H2,(H2,11,15,16).
What are the key properties of 4-(piperidin-4-ylmethyl)piperazine-1-sulfonamide?
4-(piperidin-4-ylmethyl)piperazine-1-sulfonamide has a molecular weight of 262.38 g/mol, XLogP of -1.19, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(piperidin-4-ylmethyl)piperazine-1-sulfonamide is sourced from PubChem (CID 119929956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).