N-(2-cyclohexylethyl)piperazine-1-sulfonamide

C12H25N3O2S — CID 54932858

IUPACN-(2-cyclohexylethyl)piperazine-1-sulfonamide
SMILESO=S(=O)(NCCC1CCCCC1)N1CCNCC1
InChIInChI=1S/C12H25N3O2S/c16-18(17,15-10-8-13-9-11-15)14-7-6-12-4-2-1-3-5-12/h12-14H,1-11H2
InChIKeyRUKXXYUHNFUTGD-UHFFFAOYSA-N
MW275.42 g/mol
LogP0.70
Rot. Bonds5

About N-(2-cyclohexylethyl)piperazine-1-sulfonamide

N-(2-cyclohexylethyl)piperazine-1-sulfonamide (PubChem CID 54932858) has the molecular formula C12H25N3O2S and a molecular weight of 275.42 g/mol. Its IUPAC name is N-(2-cyclohexylethyl)piperazine-1-sulfonamide.

Molecular Properties

Compound NameN-(2-cyclohexylethyl)piperazine-1-sulfonamide
PubChem CID54932858
Molecular FormulaC12H25N3O2S
Molecular Weight275.42 g/mol
Exact Mass275.17
IUPAC NameN-(2-cyclohexylethyl)piperazine-1-sulfonamide
SMILESO=S(=O)(NCCC1CCCCC1)N1CCNCC1
InChIInChI=1S/C12H25N3O2S/c16-18(17,15-10-8-13-9-11-15)14-7-6-12-4-2-1-3-5-12/h12-14H,1-11H2
InChIKeyRUKXXYUHNFUTGD-UHFFFAOYSA-N
XLogP0.70
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.42
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-cyclopentylethylsulfamoyl)piperidine-4-carboxylic acid
CID 60920685
N-[2-(methylamino)ethyl]piperazine-1-sulfonamide
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N-(2-pyrrolidin-2-ylethyl)azepane-1-sulfonamide
CID 114794249
N-(2-methylsulfanylethyl)piperazine-1-sulfonamide
CID 63958312
N-(2-cyclohexylethyl)-3-piperazin-1-ylpropan-1-amine
CID 115230614
N-(2-cyclohexylethyl)pyrrolidine-3-sulfonamide
CID 65421145
N-(2-piperidin-3-ylethyl)-3,4-dihydro-1H-isoquinoline-2-sulfonamide;hydrochloride
CID 119979174
N-[(2-methylcyclopentyl)methyl]piperazine-1-sulfonamide
CID 107419038
N-(3-propoxypropyl)piperazine-1-sulfonamide
CID 82943293
N-[3-(oxolan-2-ylmethoxy)propyl]piperazine-1-sulfonamide
CID 61254669
1-bromo-N-(2-cyclohexylethyl)methanesulfonamide
CID 83083703
4-methyl-N-(2-piperazin-1-ylethyl)piperidine-1-sulfonamide;dihydrochloride
CID 119966686

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexylethyl)piperazine-1-sulfonamide?
The IUPAC name of N-(2-cyclohexylethyl)piperazine-1-sulfonamide (CID 54932858) is N-(2-cyclohexylethyl)piperazine-1-sulfonamide.
What is the SMILES notation for N-(2-cyclohexylethyl)piperazine-1-sulfonamide?
The canonical SMILES for N-(2-cyclohexylethyl)piperazine-1-sulfonamide is O=S(=O)(NCCC1CCCCC1)N1CCNCC1.
What is the InChIKey of N-(2-cyclohexylethyl)piperazine-1-sulfonamide?
The InChIKey is RUKXXYUHNFUTGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O2S/c16-18(17,15-10-8-13-9-11-15)14-7-6-12-4-2-1-3-5-12/h12-14H,1-11H2.
What are the key properties of N-(2-cyclohexylethyl)piperazine-1-sulfonamide?
N-(2-cyclohexylethyl)piperazine-1-sulfonamide has a molecular weight of 275.42 g/mol, XLogP of 0.70, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexylethyl)piperazine-1-sulfonamide is sourced from PubChem (CID 54932858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).