N-(3-methylcyclopentyl)piperazine-1-sulfonamide

C10H21N3O2S — CID 114541483

IUPACN-(3-methylcyclopentyl)piperazine-1-sulfonamide
SMILESCC1CCC(NS(=O)(=O)N2CCNCC2)C1
InChIInChI=1S/C10H21N3O2S/c1-9-2-3-10(8-9)12-16(14,15)13-6-4-11-5-7-13/h9-12H,2-8H2,1H3
InChIKeyICSAHKCFDJLDMA-UHFFFAOYSA-N
MW247.36 g/mol
LogP-0.09
Rot. Bonds3

About N-(3-methylcyclopentyl)piperazine-1-sulfonamide

N-(3-methylcyclopentyl)piperazine-1-sulfonamide (PubChem CID 114541483) has the molecular formula C10H21N3O2S and a molecular weight of 247.36 g/mol. Its IUPAC name is N-(3-methylcyclopentyl)piperazine-1-sulfonamide.

Molecular Properties

Compound NameN-(3-methylcyclopentyl)piperazine-1-sulfonamide
PubChem CID114541483
Molecular FormulaC10H21N3O2S
Molecular Weight247.36 g/mol
Exact Mass247.14
IUPAC NameN-(3-methylcyclopentyl)piperazine-1-sulfonamide
SMILESCC1CCC(NS(=O)(=O)N2CCNCC2)C1
InChIInChI=1S/C10H21N3O2S/c1-9-2-3-10(8-9)12-16(14,15)13-6-4-11-5-7-13/h9-12H,2-8H2,1H3
InChIKeyICSAHKCFDJLDMA-UHFFFAOYSA-N
XLogP-0.09
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.36
LogP ≤ 5-0.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-methylcyclopentyl)piperazine-1-sulfonamide?
The IUPAC name of N-(3-methylcyclopentyl)piperazine-1-sulfonamide (CID 114541483) is N-(3-methylcyclopentyl)piperazine-1-sulfonamide.
What is the SMILES notation for N-(3-methylcyclopentyl)piperazine-1-sulfonamide?
The canonical SMILES for N-(3-methylcyclopentyl)piperazine-1-sulfonamide is CC1CCC(NS(=O)(=O)N2CCNCC2)C1.
What is the InChIKey of N-(3-methylcyclopentyl)piperazine-1-sulfonamide?
The InChIKey is ICSAHKCFDJLDMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O2S/c1-9-2-3-10(8-9)12-16(14,15)13-6-4-11-5-7-13/h9-12H,2-8H2,1H3.
What are the key properties of N-(3-methylcyclopentyl)piperazine-1-sulfonamide?
N-(3-methylcyclopentyl)piperazine-1-sulfonamide has a molecular weight of 247.36 g/mol, XLogP of -0.09, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylcyclopentyl)piperazine-1-sulfonamide is sourced from PubChem (CID 114541483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).