N-[(2R)-2-hydroxypropyl]oxane-4-sulfonamide

C8H17NO4S — CID 83029694

IUPACN-[(2R)-2-hydroxypropyl]oxane-4-sulfonamide
SMILESC[C@@H](O)CNS(=O)(=O)C1CCOCC1
InChIInChI=1S/C8H17NO4S/c1-7(10)6-9-14(11,12)8-2-4-13-5-3-8/h7-10H,2-6H2,1H3/t7-/m1/s1
InChIKeyFNAXWQHMPDEOTM-SSDOTTSWSA-N
MW223.29 g/mol
LogP-0.53
Rot. Bonds4

About N-[(2R)-2-hydroxypropyl]oxane-4-sulfonamide

N-[(2R)-2-hydroxypropyl]oxane-4-sulfonamide (PubChem CID 83029694) has the molecular formula C8H17NO4S and a molecular weight of 223.29 g/mol. Its IUPAC name is N-[(2R)-2-hydroxypropyl]oxane-4-sulfonamide.

Molecular Properties

Compound NameN-[(2R)-2-hydroxypropyl]oxane-4-sulfonamide
PubChem CID83029694
Molecular FormulaC8H17NO4S
Molecular Weight223.29 g/mol
Exact Mass223.09
IUPAC NameN-[(2R)-2-hydroxypropyl]oxane-4-sulfonamide
SMILESC[C@@H](O)CNS(=O)(=O)C1CCOCC1
InChIInChI=1S/C8H17NO4S/c1-7(10)6-9-14(11,12)8-2-4-13-5-3-8/h7-10H,2-6H2,1H3/t7-/m1/s1
InChIKeyFNAXWQHMPDEOTM-SSDOTTSWSA-N
XLogP-0.53
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.29
LogP ≤ 5-0.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-hydroxypropyl)oxane-4-sulfonamide
CID 62050306
2-methyl-3-(oxan-4-ylsulfonylamino)propanoic acid
CID 62675881
N-(2-cyanopropyl)oxane-4-sulfonamide
CID 62653493
N-[(2R)-2-hydroxypropyl]-1,1-dioxothiane-4-sulfonamide
CID 83030738
methyl 2-bromo-3-(oxan-4-ylsulfonylamino)propanoate
CID 103493673
N-(2-bromo-2-cyclopropylethyl)oxane-4-sulfonamide
CID 114294616
N-(2-amino-3-ethylpentyl)oxane-4-sulfonamide
CID 114168552
N-[(2S)-2-hydroxypropyl]-1,1-dioxothiolane-3-sulfonamide
CID 83058487
N-[2-(2-chloroethyl)pentyl]oxane-4-sulfonamide
CID 114145876
N-(4-hydroxypentyl)cyclopropanesulfonamide
CID 107271165
N-[(2R)-2-methyl-3-thiophen-2-ylpropyl]oxane-4-sulfonamide
CID 97217900
N-[2-[[(2S)-butan-2-yl]-methylamino]ethyl]oxane-4-sulfonamide
CID 95617460

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-hydroxypropyl]oxane-4-sulfonamide?
The IUPAC name of N-[(2R)-2-hydroxypropyl]oxane-4-sulfonamide (CID 83029694) is N-[(2R)-2-hydroxypropyl]oxane-4-sulfonamide.
What is the SMILES notation for N-[(2R)-2-hydroxypropyl]oxane-4-sulfonamide?
The canonical SMILES for N-[(2R)-2-hydroxypropyl]oxane-4-sulfonamide is C[C@@H](O)CNS(=O)(=O)C1CCOCC1.
What is the InChIKey of N-[(2R)-2-hydroxypropyl]oxane-4-sulfonamide?
The InChIKey is FNAXWQHMPDEOTM-SSDOTTSWSA-N. The full InChI is InChI=1S/C8H17NO4S/c1-7(10)6-9-14(11,12)8-2-4-13-5-3-8/h7-10H,2-6H2,1H3/t7-/m1/s1.
What are the key properties of N-[(2R)-2-hydroxypropyl]oxane-4-sulfonamide?
N-[(2R)-2-hydroxypropyl]oxane-4-sulfonamide has a molecular weight of 223.29 g/mol, XLogP of -0.53, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-hydroxypropyl]oxane-4-sulfonamide is sourced from PubChem (CID 83029694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).