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

C11H22N2O3S — CID 55174497

IUPACN-methyl-1-(oxolan-2-ylmethylsulfonyl)piperidin-4-amine
SMILESCNC1CCN(S(=O)(=O)CC2CCCO2)CC1
InChIInChI=1S/C11H22N2O3S/c1-12-10-4-6-13(7-5-10)17(14,15)9-11-3-2-8-16-11/h10-12H,2-9H2,1H3
InChIKeyHCHXIRSQNIZZPX-UHFFFAOYSA-N
MW262.37 g/mol
LogP0.18
Rot. Bonds4

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

N-methyl-1-(oxolan-2-ylmethylsulfonyl)piperidin-4-amine (PubChem CID 55174497) has the molecular formula C11H22N2O3S and a molecular weight of 262.37 g/mol. Its IUPAC name is N-methyl-1-(oxolan-2-ylmethylsulfonyl)piperidin-4-amine.

Molecular Properties

Compound NameN-methyl-1-(oxolan-2-ylmethylsulfonyl)piperidin-4-amine
PubChem CID55174497
Molecular FormulaC11H22N2O3S
Molecular Weight262.37 g/mol
Exact Mass262.14
IUPAC NameN-methyl-1-(oxolan-2-ylmethylsulfonyl)piperidin-4-amine
SMILESCNC1CCN(S(=O)(=O)CC2CCCO2)CC1
InChIInChI=1S/C11H22N2O3S/c1-12-10-4-6-13(7-5-10)17(14,15)9-11-3-2-8-16-11/h10-12H,2-9H2,1H3
InChIKeyHCHXIRSQNIZZPX-UHFFFAOYSA-N
XLogP0.18
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.37
LogP ≤ 50.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-2-[(2R)-oxolan-2-yl]-N-(1-propan-2-ylpiperidin-4-yl)ethanesulfonamide
CID 97600534
1-(oxan-2-yl)-N-piperidin-4-yl-N-propylmethanesulfonamide
CID 119042780
1-(oxolan-2-yl)-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)methanesulfonamide
CID 63246471
N-piperidin-4-yl-2-propan-2-yloxy-N-(2,2,2-trifluoroethyl)ethanesulfonamide
CID 79592410
1-(oxolan-2-yl)-N-[6-(trifluoromethyl)piperidin-3-yl]methanesulfonamide
CID 82810868
N,N-dimethyl-2-piperidin-4-yloxyethanesulfonamide
CID 58495800
1-((2-Methoxyethyl)sulfonyl)piperidin-4-amine
CID 61608559
1-(Oxolan-2-ylmethylsulfonyl)piperidin-4-amine
CID 63246231
1-Morpholin-2-ylbutane-1-sulfonamide
CID 68741574
1-amino-4-methoxy-N-(1-propan-2-ylpiperidin-4-yl)butane-2-sulfonamide
CID 68824374
N-[[(2R)-oxolan-2-yl]methyl]piperidine-4-sulfonamide
CID 94234671
N-(1-morpholin-2-ylpropyl)methanesulfonamide
CID 139343491

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(oxolan-2-ylmethylsulfonyl)piperidin-4-amine?
The IUPAC name of N-methyl-1-(oxolan-2-ylmethylsulfonyl)piperidin-4-amine (CID 55174497) is N-methyl-1-(oxolan-2-ylmethylsulfonyl)piperidin-4-amine.
What is the SMILES notation for N-methyl-1-(oxolan-2-ylmethylsulfonyl)piperidin-4-amine?
The canonical SMILES for N-methyl-1-(oxolan-2-ylmethylsulfonyl)piperidin-4-amine is CNC1CCN(S(=O)(=O)CC2CCCO2)CC1.
What is the InChIKey of N-methyl-1-(oxolan-2-ylmethylsulfonyl)piperidin-4-amine?
The InChIKey is HCHXIRSQNIZZPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3S/c1-12-10-4-6-13(7-5-10)17(14,15)9-11-3-2-8-16-11/h10-12H,2-9H2,1H3.
What are the key properties of N-methyl-1-(oxolan-2-ylmethylsulfonyl)piperidin-4-amine?
N-methyl-1-(oxolan-2-ylmethylsulfonyl)piperidin-4-amine has a molecular weight of 262.37 g/mol, XLogP of 0.18, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(oxolan-2-ylmethylsulfonyl)piperidin-4-amine is sourced from PubChem (CID 55174497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).