N-pentan-2-yl-2-piperazin-1-ylethanesulfonamide

C11H25N3O2S — CID 54973633

IUPACN-pentan-2-yl-2-piperazin-1-ylethanesulfonamide
SMILESCCCC(C)NS(=O)(=O)CCN1CCNCC1
InChIInChI=1S/C11H25N3O2S/c1-3-4-11(2)13-17(15,16)10-9-14-7-5-12-6-8-14/h11-13H,3-10H2,1-2H3
InChIKeyRAXZTDHJNCBVOO-UHFFFAOYSA-N
MW263.41 g/mol
LogP-0.00
Rot. Bonds7

About N-pentan-2-yl-2-piperazin-1-ylethanesulfonamide

N-pentan-2-yl-2-piperazin-1-ylethanesulfonamide (PubChem CID 54973633) has the molecular formula C11H25N3O2S and a molecular weight of 263.41 g/mol. Its IUPAC name is N-pentan-2-yl-2-piperazin-1-ylethanesulfonamide.

Molecular Properties

Compound NameN-pentan-2-yl-2-piperazin-1-ylethanesulfonamide
PubChem CID54973633
Molecular FormulaC11H25N3O2S
Molecular Weight263.41 g/mol
Exact Mass263.17
IUPAC NameN-pentan-2-yl-2-piperazin-1-ylethanesulfonamide
SMILESCCCC(C)NS(=O)(=O)CCN1CCNCC1
InChIInChI=1S/C11H25N3O2S/c1-3-4-11(2)13-17(15,16)10-9-14-7-5-12-6-8-14/h11-13H,3-10H2,1-2H3
InChIKeyRAXZTDHJNCBVOO-UHFFFAOYSA-N
XLogP-0.00
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.41
LogP ≤ 5-0.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-pentan-2-yl-2-piperazin-1-ylethanesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(1-methylsulfonylpropan-2-yl)-2-piperazin-1-ylethanesulfonamide
CID 64643816
N-octan-4-yl-2-piperazin-1-ylethanesulfonamide
CID 106027308
N-(1-methoxy-3-methylbutan-2-yl)-2-piperazin-1-ylethanesulfonamide
CID 65048551
2-piperazin-1-yl-N-(2,2,3,3-tetramethylcyclopropyl)ethanesulfonamide
CID 79351202
2-piperazin-1-yl-N-(2,3,3-trimethylbutyl)ethanesulfonamide
CID 83144360
2-piperazin-1-ylethanesulfonamide
CID 54595802
N-(3-methoxycyclobutyl)-2-piperazin-1-ylethanesulfonamide
CID 114120032
N-(2-piperazin-1-ylethyl)butane-1-sulfonamide;dihydrochloride
CID 119966256
2-methyl-N-(2-piperazin-1-ylethyl)pentan-1-amine
CID 82674179
1-hydroxyethyl 2-piperazin-1-ylethanesulfonate
CID 87469546
2-piperazin-1-ylethanesulfonamide;hydrochloride
CID 86611202
1-(3-methylpentyl)piperazine
CID 45099566

Frequently Asked Questions

What is the IUPAC name of N-pentan-2-yl-2-piperazin-1-ylethanesulfonamide?
The IUPAC name of N-pentan-2-yl-2-piperazin-1-ylethanesulfonamide (CID 54973633) is N-pentan-2-yl-2-piperazin-1-ylethanesulfonamide.
What is the SMILES notation for N-pentan-2-yl-2-piperazin-1-ylethanesulfonamide?
The canonical SMILES for N-pentan-2-yl-2-piperazin-1-ylethanesulfonamide is CCCC(C)NS(=O)(=O)CCN1CCNCC1.
What is the InChIKey of N-pentan-2-yl-2-piperazin-1-ylethanesulfonamide?
The InChIKey is RAXZTDHJNCBVOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N3O2S/c1-3-4-11(2)13-17(15,16)10-9-14-7-5-12-6-8-14/h11-13H,3-10H2,1-2H3.
What are the key properties of N-pentan-2-yl-2-piperazin-1-ylethanesulfonamide?
N-pentan-2-yl-2-piperazin-1-ylethanesulfonamide has a molecular weight of 263.41 g/mol, XLogP of -0.00, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-pentan-2-yl-2-piperazin-1-ylethanesulfonamide is sourced from PubChem (CID 54973633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).