N-(piperidin-3-ylmethyl)-N-propan-2-ylpropane-2-sulfonamide

C12H26N2O2S — CID 106630952

IUPACN-(piperidin-3-ylmethyl)-N-propan-2-ylpropane-2-sulfonamide
SMILESCC(C)N(CC1CCCNC1)S(=O)(=O)C(C)C
InChIInChI=1S/C12H26N2O2S/c1-10(2)14(17(15,16)11(3)4)9-12-6-5-7-13-8-12/h10-13H,5-9H2,1-4H3
InChIKeyCJAPPHUWRPMECB-UHFFFAOYSA-N
MW262.42 g/mol
LogP1.43
Rot. Bonds5

About N-(piperidin-3-ylmethyl)-N-propan-2-ylpropane-2-sulfonamide

N-(piperidin-3-ylmethyl)-N-propan-2-ylpropane-2-sulfonamide (PubChem CID 106630952) has the molecular formula C12H26N2O2S and a molecular weight of 262.42 g/mol. Its IUPAC name is N-(piperidin-3-ylmethyl)-N-propan-2-ylpropane-2-sulfonamide.

Molecular Properties

Compound NameN-(piperidin-3-ylmethyl)-N-propan-2-ylpropane-2-sulfonamide
PubChem CID106630952
Molecular FormulaC12H26N2O2S
Molecular Weight262.42 g/mol
Exact Mass262.17
IUPAC NameN-(piperidin-3-ylmethyl)-N-propan-2-ylpropane-2-sulfonamide
SMILESCC(C)N(CC1CCCNC1)S(=O)(=O)C(C)C
InChIInChI=1S/C12H26N2O2S/c1-10(2)14(17(15,16)11(3)4)9-12-6-5-7-13-8-12/h10-13H,5-9H2,1-4H3
InChIKeyCJAPPHUWRPMECB-UHFFFAOYSA-N
XLogP1.43
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.42
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclohexyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylmethanesulfonamide
CID 106630965
N-(piperidin-3-ylmethyl)-N-propan-2-ylbenzenesulfonamide
CID 106630983
3-methoxy-N-(piperidin-3-ylmethyl)-N-propan-2-ylpropane-1-sulfonamide
CID 106630987
methyl 2-[piperidin-3-ylmethyl(propan-2-yl)sulfamoyl]acetate
CID 106630937
2-fluoro-N-(piperidin-3-ylmethyl)-N-propan-2-ylbenzenesulfonamide
CID 106630902
N-(cycloheptylmethyl)-N-(piperidin-3-ylmethyl)propan-2-amine
CID 106624258
2,5-dimethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylthiophene-3-sulfonamide
CID 106630934
N-ethyl-N-piperidin-3-ylpropane-2-sulfonamide
CID 60858628
1-methyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylimidazole-4-sulfonamide
CID 106630977
2-methyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyrazole-3-sulfonamide
CID 106630912
2-[ethyl(piperidin-3-ylmethyl)sulfamoyl]propanoic acid
CID 106631065
5-bromo-2-methyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylthiophene-3-sulfonamide
CID 106630942

Frequently Asked Questions

What is the IUPAC name of N-(piperidin-3-ylmethyl)-N-propan-2-ylpropane-2-sulfonamide?
The IUPAC name of N-(piperidin-3-ylmethyl)-N-propan-2-ylpropane-2-sulfonamide (CID 106630952) is N-(piperidin-3-ylmethyl)-N-propan-2-ylpropane-2-sulfonamide.
What is the SMILES notation for N-(piperidin-3-ylmethyl)-N-propan-2-ylpropane-2-sulfonamide?
The canonical SMILES for N-(piperidin-3-ylmethyl)-N-propan-2-ylpropane-2-sulfonamide is CC(C)N(CC1CCCNC1)S(=O)(=O)C(C)C.
What is the InChIKey of N-(piperidin-3-ylmethyl)-N-propan-2-ylpropane-2-sulfonamide?
The InChIKey is CJAPPHUWRPMECB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2S/c1-10(2)14(17(15,16)11(3)4)9-12-6-5-7-13-8-12/h10-13H,5-9H2,1-4H3.
What are the key properties of N-(piperidin-3-ylmethyl)-N-propan-2-ylpropane-2-sulfonamide?
N-(piperidin-3-ylmethyl)-N-propan-2-ylpropane-2-sulfonamide has a molecular weight of 262.42 g/mol, XLogP of 1.43, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(piperidin-3-ylmethyl)-N-propan-2-ylpropane-2-sulfonamide is sourced from PubChem (CID 106630952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).