N-propan-2-ylpiperazine-1-sulfonamide;hydrochloride

C7H18ClN3O2S — CID 75481567

IUPACN-propan-2-ylpiperazine-1-sulfonamide;hydrochloride
SMILESCC(C)NS(=O)(=O)N1CCNCC1.Cl
InChIInChI=1S/C7H17N3O2S.ClH/c1-7(2)9-13(11,12)10-5-3-8-4-6-10;/h7-9H,3-6H2,1-2H3;1H
InChIKeyZNTMYFLDCBLARD-UHFFFAOYSA-N
MW243.76 g/mol
LogP-0.44
Rot. Bonds3

About N-propan-2-ylpiperazine-1-sulfonamide;hydrochloride

N-propan-2-ylpiperazine-1-sulfonamide;hydrochloride (PubChem CID 75481567) has the molecular formula C7H18ClN3O2S and a molecular weight of 243.76 g/mol. Its IUPAC name is N-propan-2-ylpiperazine-1-sulfonamide;hydrochloride.

Molecular Properties

Compound NameN-propan-2-ylpiperazine-1-sulfonamide;hydrochloride
PubChem CID75481567
Molecular FormulaC7H18ClN3O2S
Molecular Weight243.76 g/mol
Exact Mass243.08
IUPAC NameN-propan-2-ylpiperazine-1-sulfonamide;hydrochloride
SMILESCC(C)NS(=O)(=O)N1CCNCC1.Cl
InChIInChI=1S/C7H17N3O2S.ClH/c1-7(2)9-13(11,12)10-5-3-8-4-6-10;/h7-9H,3-6H2,1-2H3;1H
InChIKeyZNTMYFLDCBLARD-UHFFFAOYSA-N
XLogP-0.44
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.76
LogP ≤ 5-0.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-propan-2-ylpiperazine-1-sulfonamide;hydrochloride?
The IUPAC name of N-propan-2-ylpiperazine-1-sulfonamide;hydrochloride (CID 75481567) is N-propan-2-ylpiperazine-1-sulfonamide;hydrochloride.
What is the SMILES notation for N-propan-2-ylpiperazine-1-sulfonamide;hydrochloride?
The canonical SMILES for N-propan-2-ylpiperazine-1-sulfonamide;hydrochloride is CC(C)NS(=O)(=O)N1CCNCC1.Cl.
What is the InChIKey of N-propan-2-ylpiperazine-1-sulfonamide;hydrochloride?
The InChIKey is ZNTMYFLDCBLARD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17N3O2S.ClH/c1-7(2)9-13(11,12)10-5-3-8-4-6-10;/h7-9H,3-6H2,1-2H3;1H.
What are the key properties of N-propan-2-ylpiperazine-1-sulfonamide;hydrochloride?
N-propan-2-ylpiperazine-1-sulfonamide;hydrochloride has a molecular weight of 243.76 g/mol, XLogP of -0.44, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-ylpiperazine-1-sulfonamide;hydrochloride is sourced from PubChem (CID 75481567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).