N-ethyl-N-(oxolan-3-ylmethyl)piperazine-1-sulfonamide

C11H23N3O3S — CID 61254765

IUPACN-ethyl-N-(oxolan-3-ylmethyl)piperazine-1-sulfonamide
SMILESCCN(CC1CCOC1)S(=O)(=O)N1CCNCC1
InChIInChI=1S/C11H23N3O3S/c1-2-13(9-11-3-8-17-10-11)18(15,16)14-6-4-12-5-7-14/h11-12H,2-10H2,1H3
InChIKeyTYWOSMMADGWUHL-UHFFFAOYSA-N
MW277.39 g/mol
LogP-0.51
Rot. Bonds5

About N-ethyl-N-(oxolan-3-ylmethyl)piperazine-1-sulfonamide

N-ethyl-N-(oxolan-3-ylmethyl)piperazine-1-sulfonamide (PubChem CID 61254765) has the molecular formula C11H23N3O3S and a molecular weight of 277.39 g/mol. Its IUPAC name is N-ethyl-N-(oxolan-3-ylmethyl)piperazine-1-sulfonamide.

Molecular Properties

Compound NameN-ethyl-N-(oxolan-3-ylmethyl)piperazine-1-sulfonamide
PubChem CID61254765
Molecular FormulaC11H23N3O3S
Molecular Weight277.39 g/mol
Exact Mass277.15
IUPAC NameN-ethyl-N-(oxolan-3-ylmethyl)piperazine-1-sulfonamide
SMILESCCN(CC1CCOC1)S(=O)(=O)N1CCNCC1
InChIInChI=1S/C11H23N3O3S/c1-2-13(9-11-3-8-17-10-11)18(15,16)14-6-4-12-5-7-14/h11-12H,2-10H2,1H3
InChIKeyTYWOSMMADGWUHL-UHFFFAOYSA-N
XLogP-0.51
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.39
LogP ≤ 5-0.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(Oxolan-3-yl)methyl]piperazine
CID 13742285
3-(4-methylpiperazin-1-yl)-N-(oxolan-3-ylmethyl)propan-1-amine
CID 43203736
2-methyl-2-(4-methylpiperazin-1-yl)-N-(oxolan-3-ylmethyl)propan-1-amine
CID 43207756
N-[2-(oxolan-3-ylmethylamino)ethyl]methanesulfonamide
CID 43208180
N-(oxolan-3-ylmethyl)piperidine-1-sulfonamide
CID 47203425
4-methyl-N-(oxolan-3-ylmethyl)piperidine-1-sulfonamide
CID 47203429
3-methyl-N-(oxolan-3-ylmethyl)piperidine-1-sulfonamide
CID 51080444
2-(4-methylsulfonylpiperazin-1-yl)-N-(oxolan-3-ylmethyl)ethanamine
CID 55133714
2-(4-methylpiperazin-1-yl)-N-(oxolan-3-ylmethyl)ethanamine
CID 60923579
3-methyl-2-(4-methylpiperazin-1-yl)-N-(oxolan-3-ylmethyl)butan-1-amine
CID 61241020
N-(oxolan-3-ylmethyl)piperazine-1-sulfonamide
CID 61251830
N-cyclopropyl-N-(oxolan-3-ylmethyl)piperazine-1-sulfonamide
CID 61254387

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(oxolan-3-ylmethyl)piperazine-1-sulfonamide?
The IUPAC name of N-ethyl-N-(oxolan-3-ylmethyl)piperazine-1-sulfonamide (CID 61254765) is N-ethyl-N-(oxolan-3-ylmethyl)piperazine-1-sulfonamide.
What is the SMILES notation for N-ethyl-N-(oxolan-3-ylmethyl)piperazine-1-sulfonamide?
The canonical SMILES for N-ethyl-N-(oxolan-3-ylmethyl)piperazine-1-sulfonamide is CCN(CC1CCOC1)S(=O)(=O)N1CCNCC1.
What is the InChIKey of N-ethyl-N-(oxolan-3-ylmethyl)piperazine-1-sulfonamide?
The InChIKey is TYWOSMMADGWUHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O3S/c1-2-13(9-11-3-8-17-10-11)18(15,16)14-6-4-12-5-7-14/h11-12H,2-10H2,1H3.
What are the key properties of N-ethyl-N-(oxolan-3-ylmethyl)piperazine-1-sulfonamide?
N-ethyl-N-(oxolan-3-ylmethyl)piperazine-1-sulfonamide has a molecular weight of 277.39 g/mol, XLogP of -0.51, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(oxolan-3-ylmethyl)piperazine-1-sulfonamide is sourced from PubChem (CID 61254765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).