N,2-dimethyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide

C11H24N2O2S — CID 106630556

IUPACN,2-dimethyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide
SMILESCC(C)CS(=O)(=O)N(C)CC1CCCCN1
InChIInChI=1S/C11H24N2O2S/c1-10(2)9-16(14,15)13(3)8-11-6-4-5-7-12-11/h10-12H,4-9H2,1-3H3
InChIKeyNZZFKGXNGZSFIZ-UHFFFAOYSA-N
MW248.39 g/mol
LogP1.05
Rot. Bonds5

About N,2-dimethyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide

N,2-dimethyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide (PubChem CID 106630556) has the molecular formula C11H24N2O2S and a molecular weight of 248.39 g/mol. Its IUPAC name is N,2-dimethyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide.

Molecular Properties

Compound NameN,2-dimethyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide
PubChem CID106630556
Molecular FormulaC11H24N2O2S
Molecular Weight248.39 g/mol
Exact Mass248.16
IUPAC NameN,2-dimethyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide
SMILESCC(C)CS(=O)(=O)N(C)CC1CCCCN1
InChIInChI=1S/C11H24N2O2S/c1-10(2)9-16(14,15)13(3)8-11-6-4-5-7-12-11/h10-12H,4-9H2,1-3H3
InChIKeyNZZFKGXNGZSFIZ-UHFFFAOYSA-N
XLogP1.05
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.39
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide
CID 106630421
N-ethyl-2-methyl-N-(pyrrolidin-2-ylmethyl)propane-1-sulfonamide
CID 106608119
N,3,3-trimethyl-N-(piperidin-2-ylmethyl)butane-1-sulfonamide
CID 106630591
N,3-dimethyl-N-(2-piperidin-2-ylethyl)butane-1-sulfonamide
CID 63855870
(2S)-2-(2-methylpropylsulfonylmethyl)piperidine
CID 97301330
2-(2-methylpropylsulfonylmethyl)piperidine
CID 71777978
N-(cyclobutylmethyl)-N-methyl-1-piperidin-2-ylmethanesulfonamide
CID 55125771
N-(2-hydroxypropyl)-N-methyl-2-piperidin-2-ylethanesulfonamide
CID 62337343
N,N-bis(2-methylpropyl)-2-piperidin-2-ylethanesulfonamide
CID 61378664
N-methyl-N-(piperidin-2-ylmethyl)azepane-1-sulfonamide
CID 106630525
2-methyl-N-(piperidin-2-ylmethyl)-N-propan-2-ylpropane-2-sulfonamide
CID 106630208
N,N-dimethyl-1-piperidin-2-ylmethanamine;dihydrochloride
CID 45075192

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide?
The IUPAC name of N,2-dimethyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide (CID 106630556) is N,2-dimethyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide.
What is the SMILES notation for N,2-dimethyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide?
The canonical SMILES for N,2-dimethyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide is CC(C)CS(=O)(=O)N(C)CC1CCCCN1.
What is the InChIKey of N,2-dimethyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide?
The InChIKey is NZZFKGXNGZSFIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2S/c1-10(2)9-16(14,15)13(3)8-11-6-4-5-7-12-11/h10-12H,4-9H2,1-3H3.
What are the key properties of N,2-dimethyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide?
N,2-dimethyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide has a molecular weight of 248.39 g/mol, XLogP of 1.05, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide is sourced from PubChem (CID 106630556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).