1-(oxolan-2-ylmethylsulfonyl)piperidin-4-amine

C10H20N2O3S — CID 63246231

IUPAC1-(oxolan-2-ylmethylsulfonyl)piperidin-4-amine
SMILESNC1CCN(S(=O)(=O)CC2CCCO2)CC1
InChIInChI=1S/C10H20N2O3S/c11-9-3-5-12(6-4-9)16(13,14)8-10-2-1-7-15-10/h9-10H,1-8,11H2
InChIKeyYTSOPVVRTQPQER-UHFFFAOYSA-N
MW248.35 g/mol
LogP-0.08
Rot. Bonds3

About 1-(oxolan-2-ylmethylsulfonyl)piperidin-4-amine

1-(oxolan-2-ylmethylsulfonyl)piperidin-4-amine (PubChem CID 63246231) has the molecular formula C10H20N2O3S and a molecular weight of 248.35 g/mol. Its IUPAC name is 1-(oxolan-2-ylmethylsulfonyl)piperidin-4-amine.

Molecular Properties

Compound Name1-(oxolan-2-ylmethylsulfonyl)piperidin-4-amine
PubChem CID63246231
Molecular FormulaC10H20N2O3S
Molecular Weight248.35 g/mol
Exact Mass248.12
IUPAC Name1-(oxolan-2-ylmethylsulfonyl)piperidin-4-amine
SMILESNC1CCN(S(=O)(=O)CC2CCCO2)CC1
InChIInChI=1S/C10H20N2O3S/c11-9-3-5-12(6-4-9)16(13,14)8-10-2-1-7-15-10/h9-10H,1-8,11H2
InChIKeyYTSOPVVRTQPQER-UHFFFAOYSA-N
XLogP-0.08
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.35
LogP ≤ 5-0.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(oxolan-2-ylmethylsulfonyl)piperidin-4-amine 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-(oxolan-2-ylmethylsulfonyl)piperidin-4-amine?
The IUPAC name of 1-(oxolan-2-ylmethylsulfonyl)piperidin-4-amine (CID 63246231) is 1-(oxolan-2-ylmethylsulfonyl)piperidin-4-amine.
What is the SMILES notation for 1-(oxolan-2-ylmethylsulfonyl)piperidin-4-amine?
The canonical SMILES for 1-(oxolan-2-ylmethylsulfonyl)piperidin-4-amine is NC1CCN(S(=O)(=O)CC2CCCO2)CC1.
What is the InChIKey of 1-(oxolan-2-ylmethylsulfonyl)piperidin-4-amine?
The InChIKey is YTSOPVVRTQPQER-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O3S/c11-9-3-5-12(6-4-9)16(13,14)8-10-2-1-7-15-10/h9-10H,1-8,11H2.
What are the key properties of 1-(oxolan-2-ylmethylsulfonyl)piperidin-4-amine?
1-(oxolan-2-ylmethylsulfonyl)piperidin-4-amine has a molecular weight of 248.35 g/mol, XLogP of -0.08, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(oxolan-2-ylmethylsulfonyl)piperidin-4-amine is sourced from PubChem (CID 63246231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).