N-methyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide

C10H22N2O2S — CID 106630421

IUPACN-methyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide
SMILESCCCS(=O)(=O)N(C)CC1CCCCN1
InChIInChI=1S/C10H22N2O2S/c1-3-8-15(13,14)12(2)9-10-6-4-5-7-11-10/h10-11H,3-9H2,1-2H3
InChIKeyBJHYMIJEOAARHH-UHFFFAOYSA-N
MW234.36 g/mol
LogP0.80
Rot. Bonds5

About N-methyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide

N-methyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide (PubChem CID 106630421) has the molecular formula C10H22N2O2S and a molecular weight of 234.36 g/mol. Its IUPAC name is N-methyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide.

Molecular Properties

Compound NameN-methyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide
PubChem CID106630421
Molecular FormulaC10H22N2O2S
Molecular Weight234.36 g/mol
Exact Mass234.14
IUPAC NameN-methyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide
SMILESCCCS(=O)(=O)N(C)CC1CCCCN1
InChIInChI=1S/C10H22N2O2S/c1-3-8-15(13,14)12(2)9-10-6-4-5-7-11-10/h10-11H,3-9H2,1-2H3
InChIKeyBJHYMIJEOAARHH-UHFFFAOYSA-N
XLogP0.80
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.36
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,3,3-trimethyl-N-(piperidin-2-ylmethyl)butane-1-sulfonamide
CID 106630591
N-methyl-2-piperidin-2-yl-N-propylethanesulfonamide
CID 60863663
N,2-dimethyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide
CID 106630556
N-(cyclopentylmethyl)-N-methylpropane-1-sulfonamide
CID 62068860
N-[2-(dimethylamino)ethyl]-N-methyl-2-piperidin-2-ylethanesulfonamide
CID 63700740
N-(cyclobutylmethyl)-N-methyl-1-piperidin-2-ylmethanesulfonamide
CID 55125771
N-cyclopropyl-N-(piperidin-2-ylmethyl)butane-1-sulfonamide
CID 106630038
N-(2-hydroxypropyl)-N-methyl-2-piperidin-2-ylethanesulfonamide
CID 62337343
N-methyl-N-(piperidin-2-ylmethyl)azepane-1-sulfonamide
CID 106630525
3-methylsulfonyl-N-(piperidin-2-ylmethyl)-N-propylpropan-1-amine
CID 106635862
N,3-dimethyl-N-(2-piperidin-2-ylethyl)butane-1-sulfonamide
CID 63855870
N-ethyl-N-[[(2S)-piperidin-2-yl]methyl]ethanamine
CID 6999827

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide?
The IUPAC name of N-methyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide (CID 106630421) is N-methyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide.
What is the SMILES notation for N-methyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide?
The canonical SMILES for N-methyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide is CCCS(=O)(=O)N(C)CC1CCCCN1.
What is the InChIKey of N-methyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide?
The InChIKey is BJHYMIJEOAARHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O2S/c1-3-8-15(13,14)12(2)9-10-6-4-5-7-11-10/h10-11H,3-9H2,1-2H3.
What are the key properties of N-methyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide?
N-methyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide has a molecular weight of 234.36 g/mol, XLogP of 0.80, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide is sourced from PubChem (CID 106630421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).