1-naphthalen-2-ylsulfonylpiperazine

C14H16N2O2S — CID 703957

IUPAC1-naphthalen-2-ylsulfonylpiperazine
SMILESO=S(=O)(c1ccc2ccccc2c1)N1CCNCC1
InChIInChI=1S/C14H16N2O2S/c17-19(18,16-9-7-15-8-10-16)14-6-5-12-3-1-2-4-13(12)11-14/h1-6,11,15H,7-10H2
InChIKeyOJWPAXRMRPPQBG-UHFFFAOYSA-N
MW276.36 g/mol
LogP1.43
Rot. Bonds2

About 1-naphthalen-2-ylsulfonylpiperazine

1-naphthalen-2-ylsulfonylpiperazine (PubChem CID 703957) has the molecular formula C14H16N2O2S and a molecular weight of 276.36 g/mol. Its IUPAC name is 1-naphthalen-2-ylsulfonylpiperazine.

Molecular Properties

Compound Name1-naphthalen-2-ylsulfonylpiperazine
PubChem CID703957
Molecular FormulaC14H16N2O2S
Molecular Weight276.36 g/mol
Exact Mass276.09
IUPAC Name1-naphthalen-2-ylsulfonylpiperazine
SMILESO=S(=O)(c1ccc2ccccc2c1)N1CCNCC1
InChIInChI=1S/C14H16N2O2S/c17-19(18,16-9-7-15-8-10-16)14-6-5-12-3-1-2-4-13(12)11-14/h1-6,11,15H,7-10H2
InChIKeyOJWPAXRMRPPQBG-UHFFFAOYSA-N
XLogP1.43
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.36
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-naphthalen-2-ylsulfonylpiperazine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-2-ylsulfonylpiperazine?
The IUPAC name of 1-naphthalen-2-ylsulfonylpiperazine (CID 703957) is 1-naphthalen-2-ylsulfonylpiperazine.
What is the SMILES notation for 1-naphthalen-2-ylsulfonylpiperazine?
The canonical SMILES for 1-naphthalen-2-ylsulfonylpiperazine is O=S(=O)(c1ccc2ccccc2c1)N1CCNCC1.
What is the InChIKey of 1-naphthalen-2-ylsulfonylpiperazine?
The InChIKey is OJWPAXRMRPPQBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2S/c17-19(18,16-9-7-15-8-10-16)14-6-5-12-3-1-2-4-13(12)11-14/h1-6,11,15H,7-10H2.
What are the key properties of 1-naphthalen-2-ylsulfonylpiperazine?
1-naphthalen-2-ylsulfonylpiperazine has a molecular weight of 276.36 g/mol, XLogP of 1.43, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-2-ylsulfonylpiperazine is sourced from PubChem (CID 703957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).