N-(4-methylpiperazin-1-yl)thiophene-2-sulfonamide

C9H15N3O2S2 — CID 830219

IUPACN-(4-methylpiperazin-1-yl)thiophene-2-sulfonamide
SMILESCN1CCN(NS(=O)(=O)c2cccs2)CC1
InChIInChI=1S/C9H15N3O2S2/c1-11-4-6-12(7-5-11)10-16(13,14)9-3-2-8-15-9/h2-3,8,10H,4-7H2,1H3
InChIKeyUETMPJKFJIAYFF-UHFFFAOYSA-N
MW261.37 g/mol
LogP0.19
Rot. Bonds3

About N-(4-methylpiperazin-1-yl)thiophene-2-sulfonamide

N-(4-methylpiperazin-1-yl)thiophene-2-sulfonamide (PubChem CID 830219) has the molecular formula C9H15N3O2S2 and a molecular weight of 261.37 g/mol. Its IUPAC name is N-(4-methylpiperazin-1-yl)thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(4-methylpiperazin-1-yl)thiophene-2-sulfonamide
PubChem CID830219
Molecular FormulaC9H15N3O2S2
Molecular Weight261.37 g/mol
Exact Mass261.06
IUPAC NameN-(4-methylpiperazin-1-yl)thiophene-2-sulfonamide
SMILESCN1CCN(NS(=O)(=O)c2cccs2)CC1
InChIInChI=1S/C9H15N3O2S2/c1-11-4-6-12(7-5-11)10-16(13,14)9-3-2-8-15-9/h2-3,8,10H,4-7H2,1H3
InChIKeyUETMPJKFJIAYFF-UHFFFAOYSA-N
XLogP0.19
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 50.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(4-methylpiperazin-1-yl)thiophene-2-sulfonamide?
The IUPAC name of N-(4-methylpiperazin-1-yl)thiophene-2-sulfonamide (CID 830219) is N-(4-methylpiperazin-1-yl)thiophene-2-sulfonamide.
What is the SMILES notation for N-(4-methylpiperazin-1-yl)thiophene-2-sulfonamide?
The canonical SMILES for N-(4-methylpiperazin-1-yl)thiophene-2-sulfonamide is CN1CCN(NS(=O)(=O)c2cccs2)CC1.
What is the InChIKey of N-(4-methylpiperazin-1-yl)thiophene-2-sulfonamide?
The InChIKey is UETMPJKFJIAYFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O2S2/c1-11-4-6-12(7-5-11)10-16(13,14)9-3-2-8-15-9/h2-3,8,10H,4-7H2,1H3.
What are the key properties of N-(4-methylpiperazin-1-yl)thiophene-2-sulfonamide?
N-(4-methylpiperazin-1-yl)thiophene-2-sulfonamide has a molecular weight of 261.37 g/mol, XLogP of 0.19, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylpiperazin-1-yl)thiophene-2-sulfonamide is sourced from PubChem (CID 830219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).