N-cyclohexyl-N-ethylpiperazine-1-sulfonamide

C12H25N3O2S — CID 43209649

IUPACN-cyclohexyl-N-ethylpiperazine-1-sulfonamide
SMILESCCN(C1CCCCC1)S(=O)(=O)N1CCNCC1
InChIInChI=1S/C12H25N3O2S/c1-2-15(12-6-4-3-5-7-12)18(16,17)14-10-8-13-9-11-14/h12-13H,2-11H2,1H3
InChIKeySVTIQVLKCCODER-UHFFFAOYSA-N
MW275.42 g/mol
LogP0.79
Rot. Bonds4

About N-cyclohexyl-N-ethylpiperazine-1-sulfonamide

N-cyclohexyl-N-ethylpiperazine-1-sulfonamide (PubChem CID 43209649) has the molecular formula C12H25N3O2S and a molecular weight of 275.42 g/mol. Its IUPAC name is N-cyclohexyl-N-ethylpiperazine-1-sulfonamide.

Molecular Properties

Compound NameN-cyclohexyl-N-ethylpiperazine-1-sulfonamide
PubChem CID43209649
Molecular FormulaC12H25N3O2S
Molecular Weight275.42 g/mol
Exact Mass275.17
IUPAC NameN-cyclohexyl-N-ethylpiperazine-1-sulfonamide
SMILESCCN(C1CCCCC1)S(=O)(=O)N1CCNCC1
InChIInChI=1S/C12H25N3O2S/c1-2-15(12-6-4-3-5-7-12)18(16,17)14-10-8-13-9-11-14/h12-13H,2-11H2,1H3
InChIKeySVTIQVLKCCODER-UHFFFAOYSA-N
XLogP0.79
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.42
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-ethylpiperazine-1-sulfonamide?
The IUPAC name of N-cyclohexyl-N-ethylpiperazine-1-sulfonamide (CID 43209649) is N-cyclohexyl-N-ethylpiperazine-1-sulfonamide.
What is the SMILES notation for N-cyclohexyl-N-ethylpiperazine-1-sulfonamide?
The canonical SMILES for N-cyclohexyl-N-ethylpiperazine-1-sulfonamide is CCN(C1CCCCC1)S(=O)(=O)N1CCNCC1.
What is the InChIKey of N-cyclohexyl-N-ethylpiperazine-1-sulfonamide?
The InChIKey is SVTIQVLKCCODER-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O2S/c1-2-15(12-6-4-3-5-7-12)18(16,17)14-10-8-13-9-11-14/h12-13H,2-11H2,1H3.
What are the key properties of N-cyclohexyl-N-ethylpiperazine-1-sulfonamide?
N-cyclohexyl-N-ethylpiperazine-1-sulfonamide has a molecular weight of 275.42 g/mol, XLogP of 0.79, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-ethylpiperazine-1-sulfonamide is sourced from PubChem (CID 43209649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).