N-methyl-N-(1-methylpiperidin-3-yl)piperazine-1-sulfonamide

C11H24N4O2S — CID 62547844

IUPACN-methyl-N-(1-methylpiperidin-3-yl)piperazine-1-sulfonamide
SMILESCN1CCCC(N(C)S(=O)(=O)N2CCNCC2)C1
InChIInChI=1S/C11H24N4O2S/c1-13-7-3-4-11(10-13)14(2)18(16,17)15-8-5-12-6-9-15/h11-12H,3-10H2,1-2H3
InChIKeyYEXPJTSDPDXBOG-UHFFFAOYSA-N
MW276.41 g/mol
LogP-0.84
Rot. Bonds3

About N-methyl-N-(1-methylpiperidin-3-yl)piperazine-1-sulfonamide

N-methyl-N-(1-methylpiperidin-3-yl)piperazine-1-sulfonamide (PubChem CID 62547844) has the molecular formula C11H24N4O2S and a molecular weight of 276.41 g/mol. Its IUPAC name is N-methyl-N-(1-methylpiperidin-3-yl)piperazine-1-sulfonamide.

Molecular Properties

Compound NameN-methyl-N-(1-methylpiperidin-3-yl)piperazine-1-sulfonamide
PubChem CID62547844
Molecular FormulaC11H24N4O2S
Molecular Weight276.41 g/mol
Exact Mass276.16
IUPAC NameN-methyl-N-(1-methylpiperidin-3-yl)piperazine-1-sulfonamide
SMILESCN1CCCC(N(C)S(=O)(=O)N2CCNCC2)C1
InChIInChI=1S/C11H24N4O2S/c1-13-7-3-4-11(10-13)14(2)18(16,17)15-8-5-12-6-9-15/h11-12H,3-10H2,1-2H3
InChIKeyYEXPJTSDPDXBOG-UHFFFAOYSA-N
XLogP-0.84
TPSA55.89 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.41
LogP ≤ 5-0.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-N-(1-methylpiperidin-3-yl)piperidine-4-sulfonamide
CID 62546301
N-methyl-N-(1-methylpiperidin-3-yl)-2-piperidin-4-ylethanesulfonamide
CID 62546278
N-methyl-N-(thiolan-3-yl)-1,4-diazepane-1-sulfonamide
CID 43296839
N-methyl-N-(1-methylpiperidin-3-yl)propane-2-sulfonamide
CID 64586876
2-[methyl-(1-methylpiperidin-3-yl)sulfamoyl]acetic acid
CID 62546054
N,1-dimethyl-N-(piperidin-4-ylmethyl)piperidin-3-amine
CID 62546416
N-(cyclopropylmethyl)-N-methylpiperazine-1-sulfonamide;hydrochloride
CID 119961510
N-methyl-N-(1-methylpiperidin-3-yl)benzenesulfonamide
CID 64587065
N-(azetidin-3-yl)-N,1-dimethylpiperidin-3-amine
CID 62785558
N-(cyclopropylmethyl)-N-propan-2-ylpiperazine-1-sulfonamide
CID 54999539
N,3-dimethyl-N-pyrrolidin-3-ylpiperidine-1-sulfonamide;hydrochloride
CID 119979100
1-methyl-1-(1-methylpiperidin-3-yl)urea
CID 62546065

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(1-methylpiperidin-3-yl)piperazine-1-sulfonamide?
The IUPAC name of N-methyl-N-(1-methylpiperidin-3-yl)piperazine-1-sulfonamide (CID 62547844) is N-methyl-N-(1-methylpiperidin-3-yl)piperazine-1-sulfonamide.
What is the SMILES notation for N-methyl-N-(1-methylpiperidin-3-yl)piperazine-1-sulfonamide?
The canonical SMILES for N-methyl-N-(1-methylpiperidin-3-yl)piperazine-1-sulfonamide is CN1CCCC(N(C)S(=O)(=O)N2CCNCC2)C1.
What is the InChIKey of N-methyl-N-(1-methylpiperidin-3-yl)piperazine-1-sulfonamide?
The InChIKey is YEXPJTSDPDXBOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N4O2S/c1-13-7-3-4-11(10-13)14(2)18(16,17)15-8-5-12-6-9-15/h11-12H,3-10H2,1-2H3.
What are the key properties of N-methyl-N-(1-methylpiperidin-3-yl)piperazine-1-sulfonamide?
N-methyl-N-(1-methylpiperidin-3-yl)piperazine-1-sulfonamide has a molecular weight of 276.41 g/mol, XLogP of -0.84, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1-methylpiperidin-3-yl)piperazine-1-sulfonamide is sourced from PubChem (CID 62547844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).