4-hydroxy-N,4-dimethyl-N-propan-2-ylpiperidine-1-sulfonamide

C10H22N2O3S — CID 81103780

IUPAC4-hydroxy-N,4-dimethyl-N-propan-2-ylpiperidine-1-sulfonamide
SMILESCC(C)N(C)S(=O)(=O)N1CCC(C)(O)CC1
InChIInChI=1S/C10H22N2O3S/c1-9(2)11(4)16(14,15)12-7-5-10(3,13)6-8-12/h9,13H,5-8H2,1-4H3
InChIKeyVLVIIWUOMYKCKM-UHFFFAOYSA-N
MW250.36 g/mol
LogP0.42
Rot. Bonds3

About 4-hydroxy-N,4-dimethyl-N-propan-2-ylpiperidine-1-sulfonamide

4-hydroxy-N,4-dimethyl-N-propan-2-ylpiperidine-1-sulfonamide (PubChem CID 81103780) has the molecular formula C10H22N2O3S and a molecular weight of 250.36 g/mol. Its IUPAC name is 4-hydroxy-N,4-dimethyl-N-propan-2-ylpiperidine-1-sulfonamide.

Molecular Properties

Compound Name4-hydroxy-N,4-dimethyl-N-propan-2-ylpiperidine-1-sulfonamide
PubChem CID81103780
Molecular FormulaC10H22N2O3S
Molecular Weight250.36 g/mol
Exact Mass250.14
IUPAC Name4-hydroxy-N,4-dimethyl-N-propan-2-ylpiperidine-1-sulfonamide
SMILESCC(C)N(C)S(=O)(=O)N1CCC(C)(O)CC1
InChIInChI=1S/C10H22N2O3S/c1-9(2)11(4)16(14,15)12-7-5-10(3,13)6-8-12/h9,13H,5-8H2,1-4H3
InChIKeyVLVIIWUOMYKCKM-UHFFFAOYSA-N
XLogP0.42
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.36
LogP ≤ 50.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N,4-dimethyl-N-propan-2-ylpiperidine-1-sulfonamide?
The IUPAC name of 4-hydroxy-N,4-dimethyl-N-propan-2-ylpiperidine-1-sulfonamide (CID 81103780) is 4-hydroxy-N,4-dimethyl-N-propan-2-ylpiperidine-1-sulfonamide.
What is the SMILES notation for 4-hydroxy-N,4-dimethyl-N-propan-2-ylpiperidine-1-sulfonamide?
The canonical SMILES for 4-hydroxy-N,4-dimethyl-N-propan-2-ylpiperidine-1-sulfonamide is CC(C)N(C)S(=O)(=O)N1CCC(C)(O)CC1.
What is the InChIKey of 4-hydroxy-N,4-dimethyl-N-propan-2-ylpiperidine-1-sulfonamide?
The InChIKey is VLVIIWUOMYKCKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O3S/c1-9(2)11(4)16(14,15)12-7-5-10(3,13)6-8-12/h9,13H,5-8H2,1-4H3.
What are the key properties of 4-hydroxy-N,4-dimethyl-N-propan-2-ylpiperidine-1-sulfonamide?
4-hydroxy-N,4-dimethyl-N-propan-2-ylpiperidine-1-sulfonamide has a molecular weight of 250.36 g/mol, XLogP of 0.42, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N,4-dimethyl-N-propan-2-ylpiperidine-1-sulfonamide is sourced from PubChem (CID 81103780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).