ethane;N-(1-ethylpiperidin-4-yl)-N-methylmethanesulfonamide

C11H26N2O2S — CID 163266604

IUPACethane;N-(1-ethylpiperidin-4-yl)-N-methylmethanesulfonamide
SMILESCC.CCN1CCC(N(C)S(C)(=O)=O)CC1
InChIInChI=1S/C9H20N2O2S.C2H6/c1-4-11-7-5-9(6-8-11)10(2)14(3,12)13;1-2/h9H,4-8H2,1-3H3;1-2H3
InChIKeyWRWQXHRTKLVYCE-UHFFFAOYSA-N
MW250.41 g/mol
LogP1.39
Rot. Bonds3

About ethane;N-(1-ethylpiperidin-4-yl)-N-methylmethanesulfonamide

ethane;N-(1-ethylpiperidin-4-yl)-N-methylmethanesulfonamide (PubChem CID 163266604) has the molecular formula C11H26N2O2S and a molecular weight of 250.41 g/mol. Its IUPAC name is ethane;N-(1-ethylpiperidin-4-yl)-N-methylmethanesulfonamide.

Molecular Properties

Compound Nameethane;N-(1-ethylpiperidin-4-yl)-N-methylmethanesulfonamide
PubChem CID163266604
Molecular FormulaC11H26N2O2S
Molecular Weight250.41 g/mol
Exact Mass250.17
IUPAC Nameethane;N-(1-ethylpiperidin-4-yl)-N-methylmethanesulfonamide
SMILESCC.CCN1CCC(N(C)S(C)(=O)=O)CC1
InChIInChI=1S/C9H20N2O2S.C2H6/c1-4-11-7-5-9(6-8-11)10(2)14(3,12)13;1-2/h9H,4-8H2,1-3H3;1-2H3
InChIKeyWRWQXHRTKLVYCE-UHFFFAOYSA-N
XLogP1.39
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.41
LogP ≤ 51.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze ethane;N-(1-ethylpiperidin-4-yl)-N-methylmethanesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

cis-2,6-Dimethyl-1-methyl sulfonyl piperidine
CID 44245252
1-Methylsulfonyl-2-(2-piperidin-1-ylethyl)piperidine
CID 249321
1-Cyclohexyl-4-(methylsulfonyl)piperazine
CID 787179
1-Methylsulfonyl-4-pentan-3-ylpiperazine
CID 130370553
N-methyl-N-{2-[(1-methylpiperidin-4-yl)amino]ethyl}methanesulfonamide
CID 50954696
2-Ethyl-1-(methylsulfonyl)piperidine
CID 4400374
2-Methyl-1-methylsulfonylpiperidine
CID 4180119
N-[1-(prop-2-yn-1-yl)piperidin-4-yl]-N-(2,2,2-trifluoroethyl)methanesulfonamide
CID 56789138
N-[1-(2-cyanoethyl)piperidin-4-yl]-N-(2,2,2-trifluoroethyl)methanesulfonamide
CID 56789140
N-(1-pentylpiperidin-4-yl)-N-(2,2,2-trifluoroethyl)methanesulfonamide
CID 56792235
N-[1-(2,2-difluoroethyl)piperidin-4-yl]-N-methylethanesulfonamide
CID 60309172
N-[1-(2,2-difluoroethyl)piperidin-4-yl]-N-ethylmethanesulfonamide
CID 60309173

Frequently Asked Questions

What is the IUPAC name of ethane;N-(1-ethylpiperidin-4-yl)-N-methylmethanesulfonamide?
The IUPAC name of ethane;N-(1-ethylpiperidin-4-yl)-N-methylmethanesulfonamide (CID 163266604) is ethane;N-(1-ethylpiperidin-4-yl)-N-methylmethanesulfonamide.
What is the SMILES notation for ethane;N-(1-ethylpiperidin-4-yl)-N-methylmethanesulfonamide?
The canonical SMILES for ethane;N-(1-ethylpiperidin-4-yl)-N-methylmethanesulfonamide is CC.CCN1CCC(N(C)S(C)(=O)=O)CC1.
What is the InChIKey of ethane;N-(1-ethylpiperidin-4-yl)-N-methylmethanesulfonamide?
The InChIKey is WRWQXHRTKLVYCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O2S.C2H6/c1-4-11-7-5-9(6-8-11)10(2)14(3,12)13;1-2/h9H,4-8H2,1-3H3;1-2H3.
What are the key properties of ethane;N-(1-ethylpiperidin-4-yl)-N-methylmethanesulfonamide?
ethane;N-(1-ethylpiperidin-4-yl)-N-methylmethanesulfonamide has a molecular weight of 250.41 g/mol, XLogP of 1.39, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-(1-ethylpiperidin-4-yl)-N-methylmethanesulfonamide is sourced from PubChem (CID 163266604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).