N-(4-hydroxycyclohexyl)-3-methylpiperidine-1-sulfonamide

C12H24N2O3S — CID 43419373

IUPACN-(4-hydroxycyclohexyl)-3-methylpiperidine-1-sulfonamide
SMILESCC1CCCN(S(=O)(=O)NC2CCC(O)CC2)C1
InChIInChI=1S/C12H24N2O3S/c1-10-3-2-8-14(9-10)18(16,17)13-11-4-6-12(15)7-5-11/h10-13,15H,2-9H2,1H3
InChIKeyLHZKUKUMMZZEAZ-UHFFFAOYSA-N
MW276.40 g/mol
LogP0.86
Rot. Bonds3

About N-(4-hydroxycyclohexyl)-3-methylpiperidine-1-sulfonamide

N-(4-hydroxycyclohexyl)-3-methylpiperidine-1-sulfonamide (PubChem CID 43419373) has the molecular formula C12H24N2O3S and a molecular weight of 276.40 g/mol. Its IUPAC name is N-(4-hydroxycyclohexyl)-3-methylpiperidine-1-sulfonamide.

Molecular Properties

Compound NameN-(4-hydroxycyclohexyl)-3-methylpiperidine-1-sulfonamide
PubChem CID43419373
Molecular FormulaC12H24N2O3S
Molecular Weight276.40 g/mol
Exact Mass276.15
IUPAC NameN-(4-hydroxycyclohexyl)-3-methylpiperidine-1-sulfonamide
SMILESCC1CCCN(S(=O)(=O)NC2CCC(O)CC2)C1
InChIInChI=1S/C12H24N2O3S/c1-10-3-2-8-14(9-10)18(16,17)13-11-4-6-12(15)7-5-11/h10-13,15H,2-9H2,1H3
InChIKeyLHZKUKUMMZZEAZ-UHFFFAOYSA-N
XLogP0.86
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.40
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxycyclohexyl)-3-methylpiperidine-1-sulfonamide?
The IUPAC name of N-(4-hydroxycyclohexyl)-3-methylpiperidine-1-sulfonamide (CID 43419373) is N-(4-hydroxycyclohexyl)-3-methylpiperidine-1-sulfonamide.
What is the SMILES notation for N-(4-hydroxycyclohexyl)-3-methylpiperidine-1-sulfonamide?
The canonical SMILES for N-(4-hydroxycyclohexyl)-3-methylpiperidine-1-sulfonamide is CC1CCCN(S(=O)(=O)NC2CCC(O)CC2)C1.
What is the InChIKey of N-(4-hydroxycyclohexyl)-3-methylpiperidine-1-sulfonamide?
The InChIKey is LHZKUKUMMZZEAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O3S/c1-10-3-2-8-14(9-10)18(16,17)13-11-4-6-12(15)7-5-11/h10-13,15H,2-9H2,1H3.
What are the key properties of N-(4-hydroxycyclohexyl)-3-methylpiperidine-1-sulfonamide?
N-(4-hydroxycyclohexyl)-3-methylpiperidine-1-sulfonamide has a molecular weight of 276.40 g/mol, XLogP of 0.86, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxycyclohexyl)-3-methylpiperidine-1-sulfonamide is sourced from PubChem (CID 43419373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).