1-(2-phenyloxolane-2-carbonyl)piperidine-4-sulfonamide

C16H22N2O4S — CID 136563445

IUPAC1-(2-phenyloxolane-2-carbonyl)piperidine-4-sulfonamide
SMILESNS(=O)(=O)C1CCN(C(=O)C2(c3ccccc3)CCCO2)CC1
InChIInChI=1S/C16H22N2O4S/c17-23(20,21)14-7-10-18(11-8-14)15(19)16(9-4-12-22-16)13-5-2-1-3-6-13/h1-3,5-6,14H,4,7-12H2,(H2,17,20,21)
InChIKeyVYHAXGCVRSAAMD-UHFFFAOYSA-N
MW338.43 g/mol
LogP0.97
Rot. Bonds3

About 1-(2-phenyloxolane-2-carbonyl)piperidine-4-sulfonamide

1-(2-phenyloxolane-2-carbonyl)piperidine-4-sulfonamide (PubChem CID 136563445) has the molecular formula C16H22N2O4S and a molecular weight of 338.43 g/mol. Its IUPAC name is 1-(2-phenyloxolane-2-carbonyl)piperidine-4-sulfonamide.

Molecular Properties

Compound Name1-(2-phenyloxolane-2-carbonyl)piperidine-4-sulfonamide
PubChem CID136563445
Molecular FormulaC16H22N2O4S
Molecular Weight338.43 g/mol
Exact Mass338.13
IUPAC Name1-(2-phenyloxolane-2-carbonyl)piperidine-4-sulfonamide
SMILESNS(=O)(=O)C1CCN(C(=O)C2(c3ccccc3)CCCO2)CC1
InChIInChI=1S/C16H22N2O4S/c17-23(20,21)14-7-10-18(11-8-14)15(19)16(9-4-12-22-16)13-5-2-1-3-6-13/h1-3,5-6,14H,4,7-12H2,(H2,17,20,21)
InChIKeyVYHAXGCVRSAAMD-UHFFFAOYSA-N
XLogP0.97
TPSA89.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.43
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2-phenyloxolane-2-carbonyl)piperidine-4-sulfonamide?
The IUPAC name of 1-(2-phenyloxolane-2-carbonyl)piperidine-4-sulfonamide (CID 136563445) is 1-(2-phenyloxolane-2-carbonyl)piperidine-4-sulfonamide.
What is the SMILES notation for 1-(2-phenyloxolane-2-carbonyl)piperidine-4-sulfonamide?
The canonical SMILES for 1-(2-phenyloxolane-2-carbonyl)piperidine-4-sulfonamide is NS(=O)(=O)C1CCN(C(=O)C2(c3ccccc3)CCCO2)CC1.
What is the InChIKey of 1-(2-phenyloxolane-2-carbonyl)piperidine-4-sulfonamide?
The InChIKey is VYHAXGCVRSAAMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O4S/c17-23(20,21)14-7-10-18(11-8-14)15(19)16(9-4-12-22-16)13-5-2-1-3-6-13/h1-3,5-6,14H,4,7-12H2,(H2,17,20,21).
What are the key properties of 1-(2-phenyloxolane-2-carbonyl)piperidine-4-sulfonamide?
1-(2-phenyloxolane-2-carbonyl)piperidine-4-sulfonamide has a molecular weight of 338.43 g/mol, XLogP of 0.97, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-phenyloxolane-2-carbonyl)piperidine-4-sulfonamide is sourced from PubChem (CID 136563445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).