N-[(2R)-1-hydroxypropan-2-yl]-2-methoxyethanesulfonamide

C6H15NO4S — CID 64722345

IUPACN-[(2R)-1-hydroxypropan-2-yl]-2-methoxyethanesulfonamide
SMILESCOCCS(=O)(=O)N[C@H](C)CO
InChIInChI=1S/C6H15NO4S/c1-6(5-8)7-12(9,10)4-3-11-2/h6-8H,3-5H2,1-2H3/t6-/m1/s1
InChIKeyJBZHZVYHADIWPI-ZCFIWIBFSA-N
MW197.26 g/mol
LogP-1.07
Rot. Bonds6

About N-[(2R)-1-hydroxypropan-2-yl]-2-methoxyethanesulfonamide

N-[(2R)-1-hydroxypropan-2-yl]-2-methoxyethanesulfonamide (PubChem CID 64722345) has the molecular formula C6H15NO4S and a molecular weight of 197.26 g/mol. Its IUPAC name is N-[(2R)-1-hydroxypropan-2-yl]-2-methoxyethanesulfonamide.

Molecular Properties

Compound NameN-[(2R)-1-hydroxypropan-2-yl]-2-methoxyethanesulfonamide
PubChem CID64722345
Molecular FormulaC6H15NO4S
Molecular Weight197.26 g/mol
Exact Mass197.07
IUPAC NameN-[(2R)-1-hydroxypropan-2-yl]-2-methoxyethanesulfonamide
SMILESCOCCS(=O)(=O)N[C@H](C)CO
InChIInChI=1S/C6H15NO4S/c1-6(5-8)7-12(9,10)4-3-11-2/h6-8H,3-5H2,1-2H3/t6-/m1/s1
InChIKeyJBZHZVYHADIWPI-ZCFIWIBFSA-N
XLogP-1.07
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.26
LogP ≤ 5-1.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-hydroxybutan-2-yl)-2-methoxyethanesulfonamide
CID 78998841
N-(1-bromopropan-2-yl)-2-methoxyethanesulfonamide
CID 114294443
N-(1-hydroxypropan-2-yl)butane-1-sulfonamide
CID 43502189
N-[(2R)-1-hydroxypropan-2-yl]-2-trimethylsilylethanesulfonamide
CID 117063206
N-[(2R)-1-hydroxypropan-2-yl]-2-methylpropane-1-sulfonamide
CID 79027401
methyl 2-(2-methoxyethylsulfonylamino)-4-methylpentanoate
CID 55014263
1,1,1-trifluoro-N-[(2R)-1-hydroxypropan-2-yl]methanesulfonamide
CID 79027896
1-cyclopropyl-N-(1-hydroxypropan-2-yl)methanesulfonamide
CID 64987940
N-[(1S)-1-(4-ethylphenyl)ethyl]-2-methoxyethanesulfonamide
CID 95733792
N-(1-hydroxypropan-2-yl)propane-2-sulfonamide
CID 58551854
N-(1-chloro-4-methylpentan-2-yl)-2-methoxyethanesulfonamide
CID 65030939
N-(4-methoxybutan-2-yl)-2-(propan-2-ylamino)ethanesulfonamide
CID 64603456

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-hydroxypropan-2-yl]-2-methoxyethanesulfonamide?
The IUPAC name of N-[(2R)-1-hydroxypropan-2-yl]-2-methoxyethanesulfonamide (CID 64722345) is N-[(2R)-1-hydroxypropan-2-yl]-2-methoxyethanesulfonamide.
What is the SMILES notation for N-[(2R)-1-hydroxypropan-2-yl]-2-methoxyethanesulfonamide?
The canonical SMILES for N-[(2R)-1-hydroxypropan-2-yl]-2-methoxyethanesulfonamide is COCCS(=O)(=O)N[C@H](C)CO.
What is the InChIKey of N-[(2R)-1-hydroxypropan-2-yl]-2-methoxyethanesulfonamide?
The InChIKey is JBZHZVYHADIWPI-ZCFIWIBFSA-N. The full InChI is InChI=1S/C6H15NO4S/c1-6(5-8)7-12(9,10)4-3-11-2/h6-8H,3-5H2,1-2H3/t6-/m1/s1.
What are the key properties of N-[(2R)-1-hydroxypropan-2-yl]-2-methoxyethanesulfonamide?
N-[(2R)-1-hydroxypropan-2-yl]-2-methoxyethanesulfonamide has a molecular weight of 197.26 g/mol, XLogP of -1.07, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-hydroxypropan-2-yl]-2-methoxyethanesulfonamide is sourced from PubChem (CID 64722345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).