N-(2-oxo-2-piperazin-1-ylethyl)methanesulfonamide

C7H15N3O3S — CID 28708791

IUPACN-(2-oxo-2-piperazin-1-ylethyl)methanesulfonamide
SMILESCS(=O)(=O)NCC(=O)N1CCNCC1
InChIInChI=1S/C7H15N3O3S/c1-14(12,13)9-6-7(11)10-4-2-8-3-5-10/h8-9H,2-6H2,1H3
InChIKeyJIUJFNTZKWZRRM-UHFFFAOYSA-N
MW221.28 g/mol
LogP-2.03
Rot. Bonds3

About N-(2-oxo-2-piperazin-1-ylethyl)methanesulfonamide

N-(2-oxo-2-piperazin-1-ylethyl)methanesulfonamide (PubChem CID 28708791) has the molecular formula C7H15N3O3S and a molecular weight of 221.28 g/mol. Its IUPAC name is N-(2-oxo-2-piperazin-1-ylethyl)methanesulfonamide.

Molecular Properties

Compound NameN-(2-oxo-2-piperazin-1-ylethyl)methanesulfonamide
PubChem CID28708791
Molecular FormulaC7H15N3O3S
Molecular Weight221.28 g/mol
Exact Mass221.08
IUPAC NameN-(2-oxo-2-piperazin-1-ylethyl)methanesulfonamide
SMILESCS(=O)(=O)NCC(=O)N1CCNCC1
InChIInChI=1S/C7H15N3O3S/c1-14(12,13)9-6-7(11)10-4-2-8-3-5-10/h8-9H,2-6H2,1H3
InChIKeyJIUJFNTZKWZRRM-UHFFFAOYSA-N
XLogP-2.03
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.28
LogP ≤ 5-2.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[4-(Methylsulfonyl)piperazin-1-Yl]ethan-1-One
CID 20585914
4-Butylsulfonylpiperazin-2-one
CID 47371379
4-(Methylsulfonyl)piperazin-2-one
CID 13190468
3-Oxopiperazine-1-sulfonamide
CID 43132045
2-(4-methylsulfonylpiperazin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide
CID 31872713
1,1-difluoro-N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)methanesulfonamide
CID 43602789
1,1,1-trifluoro-N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)methanesulfonamide
CID 54903787
1,1-difluoro-N-(2-oxo-2-piperazin-1-ylethyl)methanesulfonamide
CID 60894398
1,1,1-trifluoro-N-(2-oxo-2-piperazin-1-ylethyl)methanesulfonamide
CID 60896021
4-(Difluoromethylsulfonyl)piperazin-2-one
CID 62733685
1-(4-Methylsulfonylpiperazin-1-yl)-2-(2,2,2-trifluoroethylamino)ethanone
CID 78924245
N-(2-(4-(methylsulfonyl)piperazin-1-yl)ethyl)pivalamide hydrochloride
CID 45505509

Frequently Asked Questions

What is the IUPAC name of N-(2-oxo-2-piperazin-1-ylethyl)methanesulfonamide?
The IUPAC name of N-(2-oxo-2-piperazin-1-ylethyl)methanesulfonamide (CID 28708791) is N-(2-oxo-2-piperazin-1-ylethyl)methanesulfonamide.
What is the SMILES notation for N-(2-oxo-2-piperazin-1-ylethyl)methanesulfonamide?
The canonical SMILES for N-(2-oxo-2-piperazin-1-ylethyl)methanesulfonamide is CS(=O)(=O)NCC(=O)N1CCNCC1.
What is the InChIKey of N-(2-oxo-2-piperazin-1-ylethyl)methanesulfonamide?
The InChIKey is JIUJFNTZKWZRRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N3O3S/c1-14(12,13)9-6-7(11)10-4-2-8-3-5-10/h8-9H,2-6H2,1H3.
What are the key properties of N-(2-oxo-2-piperazin-1-ylethyl)methanesulfonamide?
N-(2-oxo-2-piperazin-1-ylethyl)methanesulfonamide has a molecular weight of 221.28 g/mol, XLogP of -2.03, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-oxo-2-piperazin-1-ylethyl)methanesulfonamide is sourced from PubChem (CID 28708791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).