N-[[(2R)-oxolan-2-yl]methyl]piperidine-4-sulfonamide;hydrochloride

C10H21ClN2O3S — CID 176667732

IUPACN-[[(2R)-oxolan-2-yl]methyl]piperidine-4-sulfonamide;hydrochloride
SMILESCl.O=S(=O)(NC[C@H]1CCCO1)C1CCNCC1
InChIInChI=1S/C10H20N2O3S.ClH/c13-16(14,10-3-5-11-6-4-10)12-8-9-2-1-7-15-9;/h9-12H,1-8H2;1H/t9-;/m1./s1
InChIKeyWFRMAHZWQQYBPN-SBSPUUFOSA-N
MW284.81 g/mol
LogP0.26
Rot. Bonds4

About N-[[(2R)-oxolan-2-yl]methyl]piperidine-4-sulfonamide;hydrochloride

N-[[(2R)-oxolan-2-yl]methyl]piperidine-4-sulfonamide;hydrochloride (PubChem CID 176667732) has the molecular formula C10H21ClN2O3S and a molecular weight of 284.81 g/mol. Its IUPAC name is N-[[(2R)-oxolan-2-yl]methyl]piperidine-4-sulfonamide;hydrochloride.

Molecular Properties

Compound NameN-[[(2R)-oxolan-2-yl]methyl]piperidine-4-sulfonamide;hydrochloride
PubChem CID176667732
Molecular FormulaC10H21ClN2O3S
Molecular Weight284.81 g/mol
Exact Mass284.10
IUPAC NameN-[[(2R)-oxolan-2-yl]methyl]piperidine-4-sulfonamide;hydrochloride
SMILESCl.O=S(=O)(NC[C@H]1CCCO1)C1CCNCC1
InChIInChI=1S/C10H20N2O3S.ClH/c13-16(14,10-3-5-11-6-4-10)12-8-9-2-1-7-15-9;/h9-12H,1-8H2;1H/t9-;/m1./s1
InChIKeyWFRMAHZWQQYBPN-SBSPUUFOSA-N
XLogP0.26
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.81
LogP ≤ 50.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[(2R)-oxolan-2-yl]methyl]piperidine-4-sulfonamide;hydrochloride?
The IUPAC name of N-[[(2R)-oxolan-2-yl]methyl]piperidine-4-sulfonamide;hydrochloride (CID 176667732) is N-[[(2R)-oxolan-2-yl]methyl]piperidine-4-sulfonamide;hydrochloride.
What is the SMILES notation for N-[[(2R)-oxolan-2-yl]methyl]piperidine-4-sulfonamide;hydrochloride?
The canonical SMILES for N-[[(2R)-oxolan-2-yl]methyl]piperidine-4-sulfonamide;hydrochloride is Cl.O=S(=O)(NC[C@H]1CCCO1)C1CCNCC1.
What is the InChIKey of N-[[(2R)-oxolan-2-yl]methyl]piperidine-4-sulfonamide;hydrochloride?
The InChIKey is WFRMAHZWQQYBPN-SBSPUUFOSA-N. The full InChI is InChI=1S/C10H20N2O3S.ClH/c13-16(14,10-3-5-11-6-4-10)12-8-9-2-1-7-15-9;/h9-12H,1-8H2;1H/t9-;/m1./s1.
What are the key properties of N-[[(2R)-oxolan-2-yl]methyl]piperidine-4-sulfonamide;hydrochloride?
N-[[(2R)-oxolan-2-yl]methyl]piperidine-4-sulfonamide;hydrochloride has a molecular weight of 284.81 g/mol, XLogP of 0.26, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(2R)-oxolan-2-yl]methyl]piperidine-4-sulfonamide;hydrochloride is sourced from PubChem (CID 176667732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).