(1-methylpiperazin-2-yl)methanesulfonamide

C6H15N3O2S — CID 139343232

IUPAC(1-methylpiperazin-2-yl)methanesulfonamide
SMILESCN1CCNCC1CS(N)(=O)=O
InChIInChI=1S/C6H15N3O2S/c1-9-3-2-8-4-6(9)5-12(7,10)11/h6,8H,2-5H2,1H3,(H2,7,10,11)
InChIKeyPQUDXGJMJHNFHM-UHFFFAOYSA-N
MW193.27 g/mol
LogP-1.82
Rot. Bonds2

About (1-methylpiperazin-2-yl)methanesulfonamide

(1-methylpiperazin-2-yl)methanesulfonamide (PubChem CID 139343232) has the molecular formula C6H15N3O2S and a molecular weight of 193.27 g/mol. Its IUPAC name is (1-methylpiperazin-2-yl)methanesulfonamide.

Molecular Properties

Compound Name(1-methylpiperazin-2-yl)methanesulfonamide
PubChem CID139343232
Molecular FormulaC6H15N3O2S
Molecular Weight193.27 g/mol
Exact Mass193.09
IUPAC Name(1-methylpiperazin-2-yl)methanesulfonamide
SMILESCN1CCNCC1CS(N)(=O)=O
InChIInChI=1S/C6H15N3O2S/c1-9-3-2-8-4-6(9)5-12(7,10)11/h6,8H,2-5H2,1H3,(H2,7,10,11)
InChIKeyPQUDXGJMJHNFHM-UHFFFAOYSA-N
XLogP-1.82
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.27
LogP ≤ 5-1.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (1-methylpiperazin-2-yl)methanesulfonamide?
The IUPAC name of (1-methylpiperazin-2-yl)methanesulfonamide (CID 139343232) is (1-methylpiperazin-2-yl)methanesulfonamide.
What is the SMILES notation for (1-methylpiperazin-2-yl)methanesulfonamide?
The canonical SMILES for (1-methylpiperazin-2-yl)methanesulfonamide is CN1CCNCC1CS(N)(=O)=O.
What is the InChIKey of (1-methylpiperazin-2-yl)methanesulfonamide?
The InChIKey is PQUDXGJMJHNFHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15N3O2S/c1-9-3-2-8-4-6(9)5-12(7,10)11/h6,8H,2-5H2,1H3,(H2,7,10,11).
What are the key properties of (1-methylpiperazin-2-yl)methanesulfonamide?
(1-methylpiperazin-2-yl)methanesulfonamide has a molecular weight of 193.27 g/mol, XLogP of -1.82, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methylpiperazin-2-yl)methanesulfonamide is sourced from PubChem (CID 139343232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).