1-(cyclobutylmethylsulfonyl)piperidin-4-amine

C10H20N2O2S — CID 67402900

IUPAC1-(cyclobutylmethylsulfonyl)piperidin-4-amine
SMILESNC1CCN(S(=O)(=O)CC2CCC2)CC1
InChIInChI=1S/C10H20N2O2S/c11-10-4-6-12(7-5-10)15(13,14)8-9-2-1-3-9/h9-10H,1-8,11H2
InChIKeyAJHDVDZORHMHFT-UHFFFAOYSA-N
MW232.35 g/mol
LogP0.54
Rot. Bonds3

About 1-(cyclobutylmethylsulfonyl)piperidin-4-amine

1-(cyclobutylmethylsulfonyl)piperidin-4-amine (PubChem CID 67402900) has the molecular formula C10H20N2O2S and a molecular weight of 232.35 g/mol. Its IUPAC name is 1-(cyclobutylmethylsulfonyl)piperidin-4-amine.

Molecular Properties

Compound Name1-(cyclobutylmethylsulfonyl)piperidin-4-amine
PubChem CID67402900
Molecular FormulaC10H20N2O2S
Molecular Weight232.35 g/mol
Exact Mass232.12
IUPAC Name1-(cyclobutylmethylsulfonyl)piperidin-4-amine
SMILESNC1CCN(S(=O)(=O)CC2CCC2)CC1
InChIInChI=1S/C10H20N2O2S/c11-10-4-6-12(7-5-10)15(13,14)8-9-2-1-3-9/h9-10H,1-8,11H2
InChIKeyAJHDVDZORHMHFT-UHFFFAOYSA-N
XLogP0.54
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.35
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclobutylmethylsulfonyl)piperidin-4-amine?
The IUPAC name of 1-(cyclobutylmethylsulfonyl)piperidin-4-amine (CID 67402900) is 1-(cyclobutylmethylsulfonyl)piperidin-4-amine.
What is the SMILES notation for 1-(cyclobutylmethylsulfonyl)piperidin-4-amine?
The canonical SMILES for 1-(cyclobutylmethylsulfonyl)piperidin-4-amine is NC1CCN(S(=O)(=O)CC2CCC2)CC1.
What is the InChIKey of 1-(cyclobutylmethylsulfonyl)piperidin-4-amine?
The InChIKey is AJHDVDZORHMHFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2S/c11-10-4-6-12(7-5-10)15(13,14)8-9-2-1-3-9/h9-10H,1-8,11H2.
What are the key properties of 1-(cyclobutylmethylsulfonyl)piperidin-4-amine?
1-(cyclobutylmethylsulfonyl)piperidin-4-amine has a molecular weight of 232.35 g/mol, XLogP of 0.54, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclobutylmethylsulfonyl)piperidin-4-amine is sourced from PubChem (CID 67402900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).