2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)pyrazine

C18H18N4O2S — CID 18144515

IUPAC2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)pyrazine
SMILESO=S(=O)(c1ccc2ccccc2c1)N1CCN(c2cnccn2)CC1
InChIInChI=1S/C18H18N4O2S/c23-25(24,17-6-5-15-3-1-2-4-16(15)13-17)22-11-9-21(10-12-22)18-14-19-7-8-20-18/h1-8,13-14H,9-12H2
InChIKeyLCQRKFBXQYBIKQ-UHFFFAOYSA-N
MW354.44 g/mol
LogP2.14
Rot. Bonds3

About 2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)pyrazine

2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)pyrazine (PubChem CID 18144515) has the molecular formula C18H18N4O2S and a molecular weight of 354.44 g/mol. Its IUPAC name is 2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)pyrazine.

Molecular Properties

Compound Name2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)pyrazine
PubChem CID18144515
Molecular FormulaC18H18N4O2S
Molecular Weight354.44 g/mol
Exact Mass354.12
IUPAC Name2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)pyrazine
SMILESO=S(=O)(c1ccc2ccccc2c1)N1CCN(c2cnccn2)CC1
InChIInChI=1S/C18H18N4O2S/c23-25(24,17-6-5-15-3-1-2-4-16(15)13-17)22-11-9-21(10-12-22)18-14-19-7-8-20-18/h1-8,13-14H,9-12H2
InChIKeyLCQRKFBXQYBIKQ-UHFFFAOYSA-N
XLogP2.14
TPSA66.40 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.44
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]naphthalene-2-carboxamide
CID 42317966
6-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylchromen-2-one
CID 35405989
2-[4-(3-chloro-4-fluorophenyl)sulfonylpiperazin-1-yl]pyrazine
CID 23762678
2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]pyrazine
CID 2569467
4-(4-methylpiperazin-1-yl)-6-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)pyrimidine
CID 122343389
4-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-piperidin-1-ylpyrimidine
CID 122344045
2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-1,3-thiazole
CID 17451097
1-naphthalen-2-ylsulfonylpyrrolidine
CID 819722
2,2,2-trifluoro-1-[6-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-3-pyridinyl]ethanol
CID 69411310
1-methyl-4-naphthalen-2-ylsulfonylpiperazine
CID 872090
2-phenyl-N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]acetamide
CID 42318039
4-methoxy-2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)pyrimidine
CID 17413776

Frequently Asked Questions

What is the IUPAC name of 2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)pyrazine?
The IUPAC name of 2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)pyrazine (CID 18144515) is 2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)pyrazine.
What is the SMILES notation for 2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)pyrazine?
The canonical SMILES for 2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)pyrazine is O=S(=O)(c1ccc2ccccc2c1)N1CCN(c2cnccn2)CC1.
What is the InChIKey of 2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)pyrazine?
The InChIKey is LCQRKFBXQYBIKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O2S/c23-25(24,17-6-5-15-3-1-2-4-16(15)13-17)22-11-9-21(10-12-22)18-14-19-7-8-20-18/h1-8,13-14H,9-12H2.
What are the key properties of 2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)pyrazine?
2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)pyrazine has a molecular weight of 354.44 g/mol, XLogP of 2.14, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)pyrazine is sourced from PubChem (CID 18144515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).