1-(1-pyrazin-2-ylethylsulfonyl)piperidin-4-amine

C11H18N4O2S — CID 71637468

IUPAC1-(1-pyrazin-2-ylethylsulfonyl)piperidin-4-amine
SMILESCC(c1cnccn1)S(=O)(=O)N1CCC(N)CC1
InChIInChI=1S/C11H18N4O2S/c1-9(11-8-13-4-5-14-11)18(16,17)15-6-2-10(12)3-7-15/h4-5,8-10H,2-3,6-7,12H2,1H3
InChIKeyUTONHWAQYOVIJI-UHFFFAOYSA-N
MW270.36 g/mol
LogP0.29
Rot. Bonds3

About 1-(1-pyrazin-2-ylethylsulfonyl)piperidin-4-amine

1-(1-pyrazin-2-ylethylsulfonyl)piperidin-4-amine (PubChem CID 71637468) has the molecular formula C11H18N4O2S and a molecular weight of 270.36 g/mol. Its IUPAC name is 1-(1-pyrazin-2-ylethylsulfonyl)piperidin-4-amine.

Molecular Properties

Compound Name1-(1-pyrazin-2-ylethylsulfonyl)piperidin-4-amine
PubChem CID71637468
Molecular FormulaC11H18N4O2S
Molecular Weight270.36 g/mol
Exact Mass270.12
IUPAC Name1-(1-pyrazin-2-ylethylsulfonyl)piperidin-4-amine
SMILESCC(c1cnccn1)S(=O)(=O)N1CCC(N)CC1
InChIInChI=1S/C11H18N4O2S/c1-9(11-8-13-4-5-14-11)18(16,17)15-6-2-10(12)3-7-15/h4-5,8-10H,2-3,6-7,12H2,1H3
InChIKeyUTONHWAQYOVIJI-UHFFFAOYSA-N
XLogP0.29
TPSA89.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.36
LogP ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(Pyrazin-2-yl)ethane-1-sulfonamide
CID 68974932
N,N-dimethyl-3-[methyl(1-methyl-2-pyrazin-2-ylethyl)amino]propane-1-sulfonamide
CID 91836070
2-methyl-N-[(1R)-1-(5-methylpyrazin-2-yl)ethyl]propane-2-sulfinamide
CID 68488656
2-methyl-N-[1-(5-methylpyrazin-2-yl)ethyl]propane-2-sulfinamide
CID 68797446
3,3-dimethyl-N-piperidin-4-yl-N-(2-pyrazin-2-ylethyl)butane-1-sulfonamide
CID 70645906
N-piperidin-4-yl-N-(2-pyrazin-2-ylethyl)butane-1-sulfonamide
CID 70653660
(S)-2-methyl-N-[(1R)-1-(5-methylpyrazin-2-yl)ethyl]propane-2-sulfinamide
CID 121397408
(R)-N-[3-[ethyl(methyl)amino]-1-(5-methylpyrazin-2-yl)propyl]-2-methylpropane-2-sulfinamide
CID 121400958
N-piperidin-4-yl-N-(2-pyrazin-2-ylethyl)propane-1-sulfonamide
CID 123967160
1-(5-Methylpyrazin-2-yl)butane-2-sulfonamide
CID 126569622
4-(5-Methylpyrazin-2-yl)butane-2-sulfonamide
CID 126569623
(2S)-1-(5-methylpyrazin-2-yl)propane-2-sulfonamide
CID 134532315

Frequently Asked Questions

What is the IUPAC name of 1-(1-pyrazin-2-ylethylsulfonyl)piperidin-4-amine?
The IUPAC name of 1-(1-pyrazin-2-ylethylsulfonyl)piperidin-4-amine (CID 71637468) is 1-(1-pyrazin-2-ylethylsulfonyl)piperidin-4-amine.
What is the SMILES notation for 1-(1-pyrazin-2-ylethylsulfonyl)piperidin-4-amine?
The canonical SMILES for 1-(1-pyrazin-2-ylethylsulfonyl)piperidin-4-amine is CC(c1cnccn1)S(=O)(=O)N1CCC(N)CC1.
What is the InChIKey of 1-(1-pyrazin-2-ylethylsulfonyl)piperidin-4-amine?
The InChIKey is UTONHWAQYOVIJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2S/c1-9(11-8-13-4-5-14-11)18(16,17)15-6-2-10(12)3-7-15/h4-5,8-10H,2-3,6-7,12H2,1H3.
What are the key properties of 1-(1-pyrazin-2-ylethylsulfonyl)piperidin-4-amine?
1-(1-pyrazin-2-ylethylsulfonyl)piperidin-4-amine has a molecular weight of 270.36 g/mol, XLogP of 0.29, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-pyrazin-2-ylethylsulfonyl)piperidin-4-amine is sourced from PubChem (CID 71637468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).