N-(furan-2-ylmethyl)-N-methylpiperazine-1-sulfonamide

C10H17N3O3S — CID 43527042

IUPACN-(furan-2-ylmethyl)-N-methylpiperazine-1-sulfonamide
SMILESCN(Cc1ccco1)S(=O)(=O)N1CCNCC1
InChIInChI=1S/C10H17N3O3S/c1-12(9-10-3-2-8-16-10)17(14,15)13-6-4-11-5-7-13/h2-3,8,11H,4-7,9H2,1H3
InChIKeyKPWALZXDMLFPTR-UHFFFAOYSA-N
MW259.33 g/mol
LogP-0.14
Rot. Bonds4

About N-(furan-2-ylmethyl)-N-methylpiperazine-1-sulfonamide

N-(furan-2-ylmethyl)-N-methylpiperazine-1-sulfonamide (PubChem CID 43527042) has the molecular formula C10H17N3O3S and a molecular weight of 259.33 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-N-methylpiperazine-1-sulfonamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-N-methylpiperazine-1-sulfonamide
PubChem CID43527042
Molecular FormulaC10H17N3O3S
Molecular Weight259.33 g/mol
Exact Mass259.10
IUPAC NameN-(furan-2-ylmethyl)-N-methylpiperazine-1-sulfonamide
SMILESCN(Cc1ccco1)S(=O)(=O)N1CCNCC1
InChIInChI=1S/C10H17N3O3S/c1-12(9-10-3-2-8-16-10)17(14,15)13-6-4-11-5-7-13/h2-3,8,11H,4-7,9H2,1H3
InChIKeyKPWALZXDMLFPTR-UHFFFAOYSA-N
XLogP-0.14
TPSA65.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.33
LogP ≤ 5-0.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(4-fluorophenyl)methyl]-N-methylpiperazine-1-sulfonamide
CID 54979213
2-(1,4-diazepan-1-yl)-N-(furan-2-ylmethyl)-N-methylacetamide
CID 43162522
N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperazine-1-sulfonamide
CID 61253919
1-(dimethylsulfamoyl)-N-(furan-2-ylmethyl)-N-methylpiperidine-4-carboxamide
CID 70703147
N-cyclopropyl-N-(furan-2-ylmethyl)-2-piperazin-1-ylacetamide
CID 54944898
N-(furan-2-ylmethyl)-N,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 54929638
N-[(2-chloro-6-fluorophenyl)methyl]-N-methyl-1,4-diazepane-1-sulfonamide;hydrochloride
CID 120999393
N-(furan-2-ylmethyl)-N-methyl-2,3-dihydro-1H-indole-5-sulfonamide
CID 43527164
1-(2-aminophenyl)-N-(furan-2-ylmethyl)-N-methylmethanesulfonamide
CID 62022626
N-(furan-2-ylmethyl)-4-iodo-N-methylbenzenesulfonamide
CID 3820660
N-(furan-2-ylmethyl)-N-methyl-1-piperidin-4-ylmethanamine
CID 16768453
3-[furan-2-ylmethyl(methyl)sulfamoyl]propanoic acid
CID 43526885

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-N-methylpiperazine-1-sulfonamide?
The IUPAC name of N-(furan-2-ylmethyl)-N-methylpiperazine-1-sulfonamide (CID 43527042) is N-(furan-2-ylmethyl)-N-methylpiperazine-1-sulfonamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-N-methylpiperazine-1-sulfonamide?
The canonical SMILES for N-(furan-2-ylmethyl)-N-methylpiperazine-1-sulfonamide is CN(Cc1ccco1)S(=O)(=O)N1CCNCC1.
What is the InChIKey of N-(furan-2-ylmethyl)-N-methylpiperazine-1-sulfonamide?
The InChIKey is KPWALZXDMLFPTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O3S/c1-12(9-10-3-2-8-16-10)17(14,15)13-6-4-11-5-7-13/h2-3,8,11H,4-7,9H2,1H3.
What are the key properties of N-(furan-2-ylmethyl)-N-methylpiperazine-1-sulfonamide?
N-(furan-2-ylmethyl)-N-methylpiperazine-1-sulfonamide has a molecular weight of 259.33 g/mol, XLogP of -0.14, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-N-methylpiperazine-1-sulfonamide is sourced from PubChem (CID 43527042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).