N-ethyl-3-methylpiperidine-1-sulfonamide

C8H18N2O2S — CID 43243593

IUPACN-ethyl-3-methylpiperidine-1-sulfonamide
SMILESCCNS(=O)(=O)N1CCCC(C)C1
InChIInChI=1S/C8H18N2O2S/c1-3-9-13(11,12)10-6-4-5-8(2)7-10/h8-9H,3-7H2,1-2H3
InChIKeySWYBSLAEBLCYDC-UHFFFAOYSA-N
MW206.31 g/mol
LogP0.57
Rot. Bonds3

About N-ethyl-3-methylpiperidine-1-sulfonamide

N-ethyl-3-methylpiperidine-1-sulfonamide (PubChem CID 43243593) has the molecular formula C8H18N2O2S and a molecular weight of 206.31 g/mol. Its IUPAC name is N-ethyl-3-methylpiperidine-1-sulfonamide.

Molecular Properties

Compound NameN-ethyl-3-methylpiperidine-1-sulfonamide
PubChem CID43243593
Molecular FormulaC8H18N2O2S
Molecular Weight206.31 g/mol
Exact Mass206.11
IUPAC NameN-ethyl-3-methylpiperidine-1-sulfonamide
SMILESCCNS(=O)(=O)N1CCCC(C)C1
InChIInChI=1S/C8H18N2O2S/c1-3-9-13(11,12)10-6-4-5-8(2)7-10/h8-9H,3-7H2,1-2H3
InChIKeySWYBSLAEBLCYDC-UHFFFAOYSA-N
XLogP0.57
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.31
LogP ≤ 50.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(piperidin-3-ylmethyl)methanesulfonamide
CID 4343050
4-(2-Aminoethyl)piperidine-1-sulfonamide hydrochloride
CID 12282079
N-(piperidin-3-ylmethyl)aminosulfonamide
CID 21186538
N-[2-(piperidin-4-yl)ethyl]aminosulfonamide hydrochloride
CID 137945309
4-(Aminomethyl)piperidine-1-sulfonamide hydrochloride
CID 154963565
N,N,4-trimethylpiperidine-1-sulfonamide
CID 224932
N-[2-(1-methylpiperidin-4-yl)ethyl]methanesulfonamide
CID 72025553
N-propylpiperidine-1-sulfonamide
CID 43243224
4-(aminomethyl)-N,N-dimethylpiperidine-1-sulfonamide hydrochloride
CID 71756529
(3S)-N-cycloheptyl-3-methylpiperidine-1-sulfonamide
CID 35431097
N-cyclopentyl-4-methylpiperidine-1-sulfonamide
CID 43053240
4-methyl-N-(3-methylbutan-2-yl)piperidine-1-sulfonamide
CID 43053258

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-methylpiperidine-1-sulfonamide?
The IUPAC name of N-ethyl-3-methylpiperidine-1-sulfonamide (CID 43243593) is N-ethyl-3-methylpiperidine-1-sulfonamide.
What is the SMILES notation for N-ethyl-3-methylpiperidine-1-sulfonamide?
The canonical SMILES for N-ethyl-3-methylpiperidine-1-sulfonamide is CCNS(=O)(=O)N1CCCC(C)C1.
What is the InChIKey of N-ethyl-3-methylpiperidine-1-sulfonamide?
The InChIKey is SWYBSLAEBLCYDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O2S/c1-3-9-13(11,12)10-6-4-5-8(2)7-10/h8-9H,3-7H2,1-2H3.
What are the key properties of N-ethyl-3-methylpiperidine-1-sulfonamide?
N-ethyl-3-methylpiperidine-1-sulfonamide has a molecular weight of 206.31 g/mol, XLogP of 0.57, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-methylpiperidine-1-sulfonamide is sourced from PubChem (CID 43243593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).