2-methoxy-N-[(3R)-piperidin-3-yl]ethanesulfonamide

C8H18N2O3S — CID 104645644

IUPAC2-methoxy-N-[(3R)-piperidin-3-yl]ethanesulfonamide
SMILESCOCCS(=O)(=O)N[C@@H]1CCCNC1
InChIInChI=1S/C8H18N2O3S/c1-13-5-6-14(11,12)10-8-3-2-4-9-7-8/h8-10H,2-7H2,1H3/t8-/m1/s1
InChIKeyYCWWCTDWTQEDPT-MRVPVSSYSA-N
MW222.31 g/mol
LogP-0.70
Rot. Bonds5

About 2-methoxy-N-[(3R)-piperidin-3-yl]ethanesulfonamide

2-methoxy-N-[(3R)-piperidin-3-yl]ethanesulfonamide (PubChem CID 104645644) has the molecular formula C8H18N2O3S and a molecular weight of 222.31 g/mol. Its IUPAC name is 2-methoxy-N-[(3R)-piperidin-3-yl]ethanesulfonamide.

Molecular Properties

Compound Name2-methoxy-N-[(3R)-piperidin-3-yl]ethanesulfonamide
PubChem CID104645644
Molecular FormulaC8H18N2O3S
Molecular Weight222.31 g/mol
Exact Mass222.10
IUPAC Name2-methoxy-N-[(3R)-piperidin-3-yl]ethanesulfonamide
SMILESCOCCS(=O)(=O)N[C@@H]1CCCNC1
InChIInChI=1S/C8H18N2O3S/c1-13-5-6-14(11,12)10-8-3-2-4-9-7-8/h8-10H,2-7H2,1H3/t8-/m1/s1
InChIKeyYCWWCTDWTQEDPT-MRVPVSSYSA-N
XLogP-0.70
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.31
LogP ≤ 5-0.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methoxyethylsulfamoyl)piperidin-3-amine
CID 114814253
N-[(3S)-piperidin-3-yl]ethanesulfonamide;hydrochloride
CID 53256488
N-[(3R)-piperidin-3-yl]but-3-ene-1-sulfonamide;hydrochloride
CID 120723752
N-pyrrolidin-3-ylpropane-1-sulfonamide;hydrochloride
CID 50988223
1-cyclopropyl-N-[(3S)-piperidin-3-yl]methanesulfonamide;hydrochloride
CID 120716613
methyl 3-[[(3S)-pyrrolidin-3-yl]sulfamoyl]propanoate
CID 79684956
4-(2-methoxyethoxy)-N-piperidin-3-ylbenzenesulfonamide
CID 63321022
N-(azepan-3-yl)-1-methylsulfonylmethanesulfonamide
CID 82842865
methyl 4-[[(3R)-piperidin-3-yl]sulfamoylmethyl]benzoate
CID 104645715
3,3-dimethyl-N-pyrrolidin-3-ylbutane-1-sulfonamide
CID 103828888
N-[(3R)-pyrrolidin-3-yl]ethanesulfonamide
CID 79684935
3-(methoxymethyl)-N-piperidin-3-ylbenzenesulfonamide
CID 119964445

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[(3R)-piperidin-3-yl]ethanesulfonamide?
The IUPAC name of 2-methoxy-N-[(3R)-piperidin-3-yl]ethanesulfonamide (CID 104645644) is 2-methoxy-N-[(3R)-piperidin-3-yl]ethanesulfonamide.
What is the SMILES notation for 2-methoxy-N-[(3R)-piperidin-3-yl]ethanesulfonamide?
The canonical SMILES for 2-methoxy-N-[(3R)-piperidin-3-yl]ethanesulfonamide is COCCS(=O)(=O)N[C@@H]1CCCNC1.
What is the InChIKey of 2-methoxy-N-[(3R)-piperidin-3-yl]ethanesulfonamide?
The InChIKey is YCWWCTDWTQEDPT-MRVPVSSYSA-N. The full InChI is InChI=1S/C8H18N2O3S/c1-13-5-6-14(11,12)10-8-3-2-4-9-7-8/h8-10H,2-7H2,1H3/t8-/m1/s1.
What are the key properties of 2-methoxy-N-[(3R)-piperidin-3-yl]ethanesulfonamide?
2-methoxy-N-[(3R)-piperidin-3-yl]ethanesulfonamide has a molecular weight of 222.31 g/mol, XLogP of -0.70, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[(3R)-piperidin-3-yl]ethanesulfonamide is sourced from PubChem (CID 104645644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).