1-[(6-methoxy-3-pyridinyl)sulfonyl]-4-methylpiperazine

C11H17N3O3S — CID 2991320

IUPAC1-[(6-methoxy-3-pyridinyl)sulfonyl]-4-methylpiperazine
SMILESCOc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1
InChIInChI=1S/C11H17N3O3S/c1-13-5-7-14(8-6-13)18(15,16)10-3-4-11(17-2)12-9-10/h3-4,9H,5-8H2,1-2H3
InChIKeyZASCAVMYQYEYON-UHFFFAOYSA-N
MW271.34 g/mol
LogP0.03
Rot. Bonds3

About 1-[(6-methoxy-3-pyridinyl)sulfonyl]-4-methylpiperazine

1-[(6-methoxy-3-pyridinyl)sulfonyl]-4-methylpiperazine (PubChem CID 2991320) has the molecular formula C11H17N3O3S and a molecular weight of 271.34 g/mol. Its IUPAC name is 1-[(6-methoxy-3-pyridinyl)sulfonyl]-4-methylpiperazine.

Molecular Properties

Compound Name1-[(6-methoxy-3-pyridinyl)sulfonyl]-4-methylpiperazine
PubChem CID2991320
Molecular FormulaC11H17N3O3S
Molecular Weight271.34 g/mol
Exact Mass271.10
IUPAC Name1-[(6-methoxy-3-pyridinyl)sulfonyl]-4-methylpiperazine
SMILESCOc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1
InChIInChI=1S/C11H17N3O3S/c1-13-5-7-14(8-6-13)18(15,16)10-3-4-11(17-2)12-9-10/h3-4,9H,5-8H2,1-2H3
InChIKeyZASCAVMYQYEYON-UHFFFAOYSA-N
XLogP0.03
TPSA62.74 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.34
LogP ≤ 50.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-[(4-Methoxyphenyl)sulfonyl]-4-(3-pyridylmethyl)piperazine
CID 828758
2-(Difluoromethoxy)pyridine-3-sulfonyl chloride
CID 139300692
4-butoxy-N-pyridin-3-ylbenzenesulfonamide
CID 3239781
4-Methoxy-N-pyridin-3-yl-benzenesulfonamide
CID 771985
N,N-diethyl-6-methoxy-3-pyridinesulfonamide
CID 829840
4-methoxy-N-{[1-(pyridin-3-ylmethyl)piperidin-3-yl]methyl}benzenesulfonamide
CID 16189549
1-Methyl-4-[[6-(4-propoxyphenoxy)-3-pyridinyl]sulfonyl]piperazine
CID 24982380
4-[4-(2-Methoxyphenyl)piperazin-1-yl]pyridine-3-sulfonamide
CID 73349518
N,N-dibenzyl-2-methoxypyridine-3-sulfonamide
CID 162647773
2,4-difluoro-N-(6-methoxy-3-pyridinyl)benzenesulfonamide
CID 2414064
2-(2-methoxyphenyl)sulfonyl-1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine
CID 4827451
4-Methoxy-N-pyridin-2-ylmethyl-benzenesulfonamide
CID 668975

Frequently Asked Questions

What is the IUPAC name of 1-[(6-methoxy-3-pyridinyl)sulfonyl]-4-methylpiperazine?
The IUPAC name of 1-[(6-methoxy-3-pyridinyl)sulfonyl]-4-methylpiperazine (CID 2991320) is 1-[(6-methoxy-3-pyridinyl)sulfonyl]-4-methylpiperazine.
What is the SMILES notation for 1-[(6-methoxy-3-pyridinyl)sulfonyl]-4-methylpiperazine?
The canonical SMILES for 1-[(6-methoxy-3-pyridinyl)sulfonyl]-4-methylpiperazine is COc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1.
What is the InChIKey of 1-[(6-methoxy-3-pyridinyl)sulfonyl]-4-methylpiperazine?
The InChIKey is ZASCAVMYQYEYON-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O3S/c1-13-5-7-14(8-6-13)18(15,16)10-3-4-11(17-2)12-9-10/h3-4,9H,5-8H2,1-2H3.
What are the key properties of 1-[(6-methoxy-3-pyridinyl)sulfonyl]-4-methylpiperazine?
1-[(6-methoxy-3-pyridinyl)sulfonyl]-4-methylpiperazine has a molecular weight of 271.34 g/mol, XLogP of 0.03, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(6-methoxy-3-pyridinyl)sulfonyl]-4-methylpiperazine is sourced from PubChem (CID 2991320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).